N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide

C9H13N3O3 — CID 43577025

IUPACN-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(c1c[nH]c(=O)[nH]1)N(CCO)C1CC1
InChIInChI=1S/C9H13N3O3/c13-4-3-12(6-1-2-6)8(14)7-5-10-9(15)11-7/h5-6,13H,1-4H2,(H2,10,11,15)
InChIKeyIUWUROCLFJGKOM-UHFFFAOYSA-N
MW211.22 g/mol
LogP-0.70
Rot. Bonds4

About N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide

N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide (PubChem CID 43577025) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
PubChem CID43577025
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC NameN-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(c1c[nH]c(=O)[nH]1)N(CCO)C1CC1
InChIInChI=1S/C9H13N3O3/c13-4-3-12(6-1-2-6)8(14)7-5-10-9(15)11-7/h5-6,13H,1-4H2,(H2,10,11,15)
InChIKeyIUWUROCLFJGKOM-UHFFFAOYSA-N
XLogP-0.70
TPSA89.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-0.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide (CID 43577025) is N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide is O=C(c1c[nH]c(=O)[nH]1)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is IUWUROCLFJGKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c13-4-3-12(6-1-2-6)8(14)7-5-10-9(15)11-7/h5-6,13H,1-4H2,(H2,10,11,15).
What are the key properties of N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 211.22 g/mol, XLogP of -0.70, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 43577025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).