Chemical ID: 4175666

Cc1ccccc1C(=O)NCc2ccco2
Chemical ID:
4175666
Name [?]:
N-(2-furylmethyl)-2-methyl-benzamide
SMILES [?]:
Cc1ccccc1C(=O)NCc2ccco2
InChi [?]:
InChI=1/C13H13NO2/c1-10-5-2-3-7-12(10)13(15)14-9-11-6-4-8-16-11/h2-8H,9H2,1H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,4,5,14,3,13,6,15,11,2,12,7,8,10,9,16/rA:16nCCCCCCCCONCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s10;s11;d12;s13;d14;s12s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H13NO2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.5696
Area:405.318
Solvation:-2.56334
Coulombic:-29.8941
Bond Count [?]
All:17
Single:11
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:215.248
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.27
LogP (Chemaxon):2.14

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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