Chemical ID: 6335114

CCC(=O)Nc1ccccc1C
Chemical ID:
6335114
Name [?]:
N-(o-tolyl)propanamide
SMILES [?]:
CCC(=O)Nc1ccccc1C
InChi [?]:
InChI=1/C10H13NO/c1-3-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,12,2,9,8,10,7,11,6,3,5,4/rA:12nCCCONCCCCCCC/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H13NO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.68301
Area:337.636
Solvation:-1.75787
Coulombic:-20.5947
Bond Count [?]
All:12
Single:8
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:163.216
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.75
LogP (Chemaxon):1.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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