4-(dimethylamino)-1,3-dimethylimidazol-2-one

C7H13N3O — CID 69117478

IUPAC4-(dimethylamino)-1,3-dimethylimidazol-2-one
SMILESCN(C)c1cn(C)c(=O)n1C
InChIInChI=1S/C7H13N3O/c1-8(2)6-5-9(3)7(11)10(6)4/h5H,1-4H3
InChIKeyXYSRSLCXYHAKJH-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.21
Rot. Bonds1

About 4-(dimethylamino)-1,3-dimethylimidazol-2-one

4-(dimethylamino)-1,3-dimethylimidazol-2-one (PubChem CID 69117478) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 4-(dimethylamino)-1,3-dimethylimidazol-2-one.

Molecular Properties

Compound Name4-(dimethylamino)-1,3-dimethylimidazol-2-one
PubChem CID69117478
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name4-(dimethylamino)-1,3-dimethylimidazol-2-one
SMILESCN(C)c1cn(C)c(=O)n1C
InChIInChI=1S/C7H13N3O/c1-8(2)6-5-9(3)7(11)10(6)4/h5H,1-4H3
InChIKeyXYSRSLCXYHAKJH-UHFFFAOYSA-N
XLogP-0.21
TPSA30.17 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-1,3-dimethylimidazol-2-one?
The IUPAC name of 4-(dimethylamino)-1,3-dimethylimidazol-2-one (CID 69117478) is 4-(dimethylamino)-1,3-dimethylimidazol-2-one.
What is the SMILES notation for 4-(dimethylamino)-1,3-dimethylimidazol-2-one?
The canonical SMILES for 4-(dimethylamino)-1,3-dimethylimidazol-2-one is CN(C)c1cn(C)c(=O)n1C.
What is the InChIKey of 4-(dimethylamino)-1,3-dimethylimidazol-2-one?
The InChIKey is XYSRSLCXYHAKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-8(2)6-5-9(3)7(11)10(6)4/h5H,1-4H3.
What are the key properties of 4-(dimethylamino)-1,3-dimethylimidazol-2-one?
4-(dimethylamino)-1,3-dimethylimidazol-2-one has a molecular weight of 155.20 g/mol, XLogP of -0.21, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-1,3-dimethylimidazol-2-one is sourced from PubChem (CID 69117478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).