Chemical ID: 6618452

CCCC(=O)Nc1ccc(cc1Cl)N
Chemical ID:
6618452
Name [?]:
N-(4-amino-2-chloro-phenyl)butanamide
SMILES [?]:
CCCC(=O)Nc1ccc(cc1Cl)N
InChi [?]:
InChI=1/C10H13ClN2O/c1-2-3-10(14)13-9-5-4-7(12)6-8(9)11/h4-6H,2-3,12H2,1H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,3,9,8,11,10,12,7,4,13,14,6,5/rA:14nCCCCONCCCCCCClN/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s10;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H13ClN2O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.09524
Area:392.704
Solvation:-1.72236
Coulombic:-37.1625
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:212.676
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:1.48
LogP (Chemaxon):1.48

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Descriptor Annotations

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