Chemical ID: 4214505

CCC(Cc1ccccc1)NC(=O)CC
Chemical ID:
4214505
Name [?]:
N-(1-benzylpropyl)propanamide
SMILES [?]:
CCC(Cc1ccccc1)NC(=O)CC
InChi [?]:
InChI=1/C13H19NO/c1-3-12(14-13(15)4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,15,2,14,8,7,9,6,10,4,5,3,12,11,13/E:(6,7)(8,9)/rA:15cCCCCCCCCCCNCOCC/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s3;s11;d12;s12;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:8.17885
Area:401.149
Solvation:-1.84988
Coulombic:-22.2234
Bond Count [?]
All:15
Single:11
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:205.296
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.65
LogP (Chemaxon):2.75

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