Chemical ID: 6504416

CC(CO)NC(=O)c1ccccc1
Chemical ID:
6504416
Name [?]:
N-(2-hydroxy-1-methyl-ethyl)benzamide
SMILES [?]:
CC(CO)NC(=O)c1ccccc1
InChi [?]:
InChI=1/C10H13NO2/c1-8(7-12)11-10(13)9-5-3-2-4-6-9/h2-6,8,12H,7H2,1H3,(H,11,13)
InChi Info:
AuxInfo=1/1/N:1,11,10,12,9,13,3,2,8,6,5,4,7/E:(3,4)(5,6)/rA:13cCCCONCOCCCCCC/rB:s1;s2;s3;s2;s5;d6;s6;s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H13NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:6.53541
Area:360.154
Solvation:-2.46845
Coulombic:-39.9238
Bond Count [?]
All:13
Single:9
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:179.216
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.18
LogP (Chemaxon):0.91

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Descriptor Annotations

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