1,2-dimethylimidazole;urea

C6H12N4O — CID 174990589

IUPAC1,2-dimethylimidazole;urea
SMILESCc1nccn1C.NC(N)=O
InChIInChI=1S/C5H8N2.CH4N2O/c1-5-6-3-4-7(5)2;2-1(3)4/h3-4H,1-2H3;(H4,2,3,4)
InChIKeyZPEORNOWCHPEMO-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.25
Rot. Bonds

About 1,2-dimethylimidazole;urea

1,2-dimethylimidazole;urea (PubChem CID 174990589) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is 1,2-dimethylimidazole;urea.

Molecular Properties

Compound Name1,2-dimethylimidazole;urea
PubChem CID174990589
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name1,2-dimethylimidazole;urea
SMILESCc1nccn1C.NC(N)=O
InChIInChI=1S/C5H8N2.CH4N2O/c1-5-6-3-4-7(5)2;2-1(3)4/h3-4H,1-2H3;(H4,2,3,4)
InChIKeyZPEORNOWCHPEMO-UHFFFAOYSA-N
XLogP-0.25
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylimidazole;urea?
The IUPAC name of 1,2-dimethylimidazole;urea (CID 174990589) is 1,2-dimethylimidazole;urea.
What is the SMILES notation for 1,2-dimethylimidazole;urea?
The canonical SMILES for 1,2-dimethylimidazole;urea is Cc1nccn1C.NC(N)=O.
What is the InChIKey of 1,2-dimethylimidazole;urea?
The InChIKey is ZPEORNOWCHPEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.CH4N2O/c1-5-6-3-4-7(5)2;2-1(3)4/h3-4H,1-2H3;(H4,2,3,4).
What are the key properties of 1,2-dimethylimidazole;urea?
1,2-dimethylimidazole;urea has a molecular weight of 156.19 g/mol, XLogP of -0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylimidazole;urea is sourced from PubChem (CID 174990589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).