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Chemical ID: 7257329

Chemical ID:

7257329

Name [?]:

N-(2-ethyl-6-methyl-phenyl)-2-(o-tolylamino)acetamide

SMILES [?]:

CCc1cccc(c1NC(=O)CNc2ccccc2C)C

InChi [?]:

InChI=1/C18H22N2O/c1-4-15-10-7-9-14(3)18(15)20-17(21)12-19-16-11-6-5-8-13(16)2/h5-11,19H,4,12H2,1-3H3,(H,20,21)

InChi Info:

AuxInfo=1/1/N:1,20,21,2,17,16,5,18,6,4,15,12,19,7,3,14,10,8,13,9,11/rA:21nCCCCCCCCNCOCNCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;s7;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₂N₂O
All Atoms:	43
Heavy Atoms:	21
Chiral Atoms:	0

ZAP Information [?]

Total:	9.85065
Area:	496.27
Solvation:	-2.55609
Coulombic:	-33.8803

Bond Count [?]

All:	22
Single:	15
Double:	7
Rotors:	6
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	282.38
H-Bond Donors:	2
H-Bond Acceptors:	3
XLogP:	3.55
LogP (Chemaxon):	3.2

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