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Chemical ID: 6482738

CN1CCC(CC1)N(C2CCN(CC2)Cc3ccccc3)C(=O)C(c4ccccc4)c5ccccc5

Chemical ID:

6482738

Name [?]:

N-(1-benzyl-4-piperidyl)-N-(1-methyl-4-piperidyl)-2,2-diphenyl-acetamide

SMILES [?]:

CN1CCC(CC1)N(C2CCN(CC2)Cc3ccccc3)C(=O)C(c4ccccc4)c5ccccc5

InChi [?]:

InChI=1/C32H39N3O/c1-33-21-17-29(18-22-33)35(30-19-23-34(24-20-30)25-26-11-5-2-6-12-26)32(36)31(27-13-7-3-8-14-27)28-15-9-4-10-16-28/h2-16,29-31H,17-25H2,1H3

InChi Info:

AuxInfo=1/0/N:1,19,28,34,18,20,27,29,33,35,17,21,26,30,32,36,4,6,10,14,3,7,11,13,15,16,25,31,5,9,24,22,2,12,8,23/E:(3,4)(5,6)(7,8,9,10)(11,12)(13,14,15,16)(17,18)(19,20)(21,22)(23,24)(27,28)/rA:36nCNCCCCCNCCCNCCCCCCCCCCOCCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;s10;s11;s12;s9s13;s12;s15;s16;d17;s18;d19;d16s20;s8;d22;s22;s24;s25;d26;s27;d28;d25s29;s24;s31;d32;s33;d34;d31s35;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₃₂H₃₉N₃O
All Atoms:	36
Heavy Atoms:	36
Chiral Atoms:	0

ZAP Information [?]

Total:	14.0304
Area:	705.011
Solvation:	-3.59488
Coulombic:	-30.9689

Bond Count [?]

All:	40
Single:	30
Double:	10
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	481.672
H-Bond Donors:	0
H-Bond Acceptors:	4
XLogP:	5.55
LogP (Chemaxon):	4.81

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value