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Chemical ID: 6381911

Chemical ID:

6381911

Name [?]:

N-(4-diethylaminophenyl)-3-phenyl-propanamide

SMILES [?]:

CCN(CC)c1ccc(cc1)NC(=O)CCc2ccccc2

InChi [?]:

InChI=1/C19H24N2O/c1-3-21(4-2)18-13-11-17(12-14-18)20-19(22)15-10-16-8-6-5-7-9-16/h5-9,11-14H,3-4,10,15H2,1-2H3,(H,20,22)

InChi Info:

AuxInfo=1/1/N:1,5,2,4,20,19,21,18,22,16,8,10,7,11,15,17,9,6,13,12,3,14/E:(1,2)(3,4)(6,7)(8,9)(11,12)(13,14)/rA:22nCCNCCCCCCCCNCOCCCCCCCC/rB:s1;s2;s3;s4;s3;s6;d7;s8;d9;d6s10;s9;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₂₄N₂O
All Atoms:	22
Heavy Atoms:	22
Chiral Atoms:	0

ZAP Information [?]

Total:	11.0067
Area:	539.363
Solvation:	-2.47738
Coulombic:	-27.9999

Bond Count [?]

All:	23
Single:	16
Double:	7
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	296.407
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	4.03
LogP (Chemaxon):	4.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value