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Chemical ID: 6482573

Chemical ID:

6482573

Name [?]:

2,6-difluoro-N-(1-methyl-4-piperidyl)-N-propyl-benzamide

SMILES [?]:

CCCN(C1CCN(CC1)C)C(=O)c2c(cccc2F)F

InChi [?]:

InChI=1/C16H22F2N2O/c1-3-9-20(12-7-10-19(2)11-8-12)16(21)15-13(17)5-4-6-14(15)18/h4-6,12H,3,7-11H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,11,2,17,16,18,6,10,3,7,9,5,15,19,14,12,21,20,8,4,13/E:(5,6)(7,8)(10,11)(13,14)(17,18)/rA:21nCCCNCCCNCCCCOCCCCCCFF/rB:s1;s2;s3;s4;s5;s6;s7;s8;s5s9;s8;s4;d12;s12;s14;d15;s16;d17;d14s18;s19;s15;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₂₂F₂N₂O
All Atoms:	21
Heavy Atoms:	21
Chiral Atoms:	0

ZAP Information [?]

Total:	7.61154
Area:	463.396
Solvation:	-3.97336
Coulombic:	-28.623

Bond Count [?]

All:	22
Single:	18
Double:	4
Rotors:	5
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	296.356
H-Bond Donors:	0
H-Bond Acceptors:	3
XLogP:	3.07
LogP (Chemaxon):	2.26

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value