Chemical ID: 6641649

CCCCN1C(=O)C(=O)N(C1=O)C
Chemical ID:
6641649
Name [?]:
1-butyl-3-methyl-imidazolidine-2,4,5-trione
SMILES [?]:
CCCCN1C(=O)C(=O)N(C1=O)C
InChi [?]:
InChI=1/C8H12N2O3/c1-3-4-5-10-7(12)6(11)9(2)8(10)13/h3-5H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,2,3,4,8,6,11,10,5,9,7,12/rA:13nCCCCNCOCONCOC/rB:s1;s2;s3;s4;s5;d6;s6;d8;s8;s5s10;d11;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H12N2O3
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.00822
Area:360.696
Solvation:-2.00918
Coulombic:-47.28
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:184.193
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:0.2
LogP (Chemaxon):0.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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