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Chemical ID: 5753384

Chemical ID:

5753384

Name [?]:

N-(2,4-dimethylphenyl)-2-(4-methyl-1-piperidyl)-acetamide

SMILES [?]:

Cc1ccc(c(c1)C)NC(=O)CN2CCC(CC2)C

InChi [?]:

InChI=1/C16H24N2O/c1-12-6-8-18(9-7-12)11-16(19)17-15-5-4-13(2)10-14(15)3/h4-5,10,12H,6-9,11H2,1-3H3,(H,17,19)

InChi Info:

AuxInfo=1/1/N:19,1,8,3,4,15,17,14,18,7,12,16,2,6,5,10,9,13,11/E:(6,7)(8,9)/rA:19nCCCCCCCCNCOCNCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₂₄N₂O
All Atoms:	19
Heavy Atoms:	19
Chiral Atoms:	0

ZAP Information [?]

Total:	9.15615
Area:	470.406
Solvation:	-2.604
Coulombic:	-25.8968

Bond Count [?]

All:	20
Single:	16
Double:	4
Rotors:	4
Chiral:	0
Rigid Segments:	3

Chemical Properties

Molecular Weight:	260.375
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	2.84
LogP (Chemaxon):	2.58

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