Chemical ID: 7310969

CCCCCNC(=O)c1ccc2ccccc2n1
Chemical ID:
7310969
Name [?]:
N-pentylquinoline-2-carboxamide
SMILES [?]:
CCCCCNC(=O)c1ccc2ccccc2n1
InChi [?]:
InChI=1/C15H18N2O/c1-2-3-6-11-16-15(18)14-10-9-12-7-4-5-8-13(12)17-14/h4-5,7-10H,2-3,6,11H2,1H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,2,3,14,15,4,13,16,11,10,5,12,17,9,7,6,18,8/rA:18nCCCCCNCOCCCCCCCCCN/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;d10;s11;s12;d13;s14;d15;d12s16;d9s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H18N2O
All Atoms:36
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:10.0752
Area:462.654
Solvation:-1.49116
Coulombic:-31.0569
Bond Count [?]
All:19
Single:13
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:242.316
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.54
LogP (Chemaxon):3.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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