Chemical ID: 4422173

CCc1cccc(c1NC(=O)CC)CC
Chemical ID:
4422173
Name [?]:
N-(2,6-diethylphenyl)propanamide
SMILES [?]:
CCc1cccc(c1NC(=O)CC)CC
InChi [?]:
InChI=1/C13H19NO/c1-4-10-8-7-9-11(5-2)13(10)14-12(15)6-3/h7-9H,4-6H2,1-3H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,15,13,2,14,12,5,4,6,3,7,10,8,9,11/E:(1,2)(4,5)(8,9)(10,11)/rA:15nCCCCCCCCNCOCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s7;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.0823
Area:398.15
Solvation:-1.87145
Coulombic:-20.9607
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:205.296
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.91
LogP (Chemaxon):2.43

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Descriptor Annotations

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