Chemical ID: 6933794

CCCC(C)NC(=O)c1ccc(c(c1)C)C
Chemical ID:
6933794
Name [?]:
3,4-dimethyl-N-(1-methylbutyl)benzamide
SMILES [?]:
CCCC(C)NC(=O)c1ccc(c(c1)C)C
InChi [?]:
InChI=1/C14H21NO/c1-5-6-12(4)15-14(16)13-8-7-10(2)11(3)9-13/h7-9,12H,5-6H2,1-4H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,16,15,5,2,3,11,10,14,12,13,4,9,7,6,8/rA:16cCCCCCNCOCCCCCCCC/rB:s1;s2;s3;s4;s4;s6;d7;s7;s9;d10;s11;d12;d9s13;s13;s12;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO
All Atoms:37
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:9.48651
Area:434.32
Solvation:-1.37149
Coulombic:-23.8418
Bond Count [?]
All:16
Single:12
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:219.323
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.11
LogP (Chemaxon):3.5

Name Annotations

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Descriptor Annotations

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