Chemical ID: 6347641

CCCC(=O)NCc1ccncc1
Chemical ID:
6347641
Name [?]:
N-(4-pyridylmethyl)butanamide
SMILES [?]:
CCCC(=O)NCc1ccncc1
InChi [?]:
InChI=1/C10H14N2O/c1-2-3-10(13)12-8-9-4-6-11-7-5-9/h4-7H,2-3,8H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,3,9,13,10,12,7,8,4,11,6,5/E:(4,5)(6,7)/rA:13nCCCCONCCCCNCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14N2O
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.99666
Area:375.498
Solvation:-2.39078
Coulombic:-24.9451
Bond Count [?]
All:13
Single:9
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:178.231
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.99
LogP (Chemaxon):0.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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