N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide

C9H15N3O3 — CID 79383796

IUPACN-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESCN(CC(C)(C)O)C(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C9H15N3O3/c1-9(2,15)5-12(3)7(13)6-4-10-8(14)11-6/h4,15H,5H2,1-3H3,(H2,10,11,14)
InChIKeyOGAGVXLWHVWMAW-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.45
Rot. Bonds3

About N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide

N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide (PubChem CID 79383796) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
PubChem CID79383796
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC NameN-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESCN(CC(C)(C)O)C(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C9H15N3O3/c1-9(2,15)5-12(3)7(13)6-4-10-8(14)11-6/h4,15H,5H2,1-3H3,(H2,10,11,14)
InChIKeyOGAGVXLWHVWMAW-UHFFFAOYSA-N
XLogP-0.45
TPSA89.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide (CID 79383796) is N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide is CN(CC(C)(C)O)C(=O)c1c[nH]c(=O)[nH]1.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is OGAGVXLWHVWMAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-9(2,15)5-12(3)7(13)6-4-10-8(14)11-6/h4,15H,5H2,1-3H3,(H2,10,11,14).
What are the key properties of N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 213.24 g/mol, XLogP of -0.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-N-methyl-2-oxo-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 79383796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).