Chemical ID: 4212972

COCCNC(=O)C(=O)NC1CCCCCC1
Chemical ID:
4212972
Name [?]:
N'-cycloheptyl-N-(2-methoxyethyl)oxamide
SMILES [?]:
COCCNC(=O)C(=O)NC1CCCCCC1
InChi [?]:
InChI=1/C12H22N2O3/c1-17-9-8-13-11(15)12(16)14-10-6-4-2-3-5-7-10/h10H,2-9H2,1H3,(H,13,15)(H,14,16)
InChi Info:
AuxInfo=1/1/N:1,14,15,13,16,12,17,4,3,11,6,8,5,10,7,9,2/E:(2,3)(4,5)(6,7)/rA:17nCOCCNCOCONCCCCCCC/rB:s1;s2;s3;s4;s5;d6;s6;d8;s8;s10;s11;s12;s13;s14;s15;s11s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22N2O3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.2576
Area:452.318
Solvation:-3.05036
Coulombic:-55.106
Bond Count [?]
All:17
Single:15
Double:2
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:242.315
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.1
LogP (Chemaxon):0.34

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Descriptor Annotations

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