Chemical ID: 5295380

CCCCNC(=O)CN1c2ccccc2OCC1=O
Chemical ID:
5295380
Name [?]:
N-butyl-2-(9-oxo-7-oxa-10-azabicyclo[4.4.0]deca-2,4,11-trien-10-yl)-acetamide
SMILES [?]:
CCCCNC(=O)CN1c2ccccc2OCC1=O
InChi [?]:
InChI=1/C14H18N2O3/c1-2-3-8-15-13(17)9-16-11-6-4-5-7-12(11)19-10-14(16)18/h4-7H,2-3,8-10H2,1H3,(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,2,3,12,13,11,14,4,8,17,10,15,6,18,5,9,7,19,16/rA:19nCCCCNCOCNCCCCCCOCCO/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;d11;s12;d13;d10s14;s15;s16;s9s17;d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H18N2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.96317
Area:460.929
Solvation:-3.56007
Coulombic:-46.2912
Bond Count [?]
All:20
Single:15
Double:5
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:262.304
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.32
LogP (Chemaxon):0.73

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