N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide

C6H9N3O2 — CID 23629745

IUPACN-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESCCNC(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C6H9N3O2/c1-2-7-5(10)4-3-8-6(11)9-4/h3H,2H2,1H3,(H,7,10)(H2,8,9,11)
InChIKeyRHIRYRHUXSOQQF-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.55
Rot. Bonds2

About N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide

N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide (PubChem CID 23629745) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
PubChem CID23629745
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC NameN-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESCCNC(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C6H9N3O2/c1-2-7-5(10)4-3-8-6(11)9-4/h3H,2H2,1H3,(H,7,10)(H2,8,9,11)
InChIKeyRHIRYRHUXSOQQF-UHFFFAOYSA-N
XLogP-0.55
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide (CID 23629745) is N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide is CCNC(=O)c1c[nH]c(=O)[nH]1.
What is the InChIKey of N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is RHIRYRHUXSOQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-2-7-5(10)4-3-8-6(11)9-4/h3H,2H2,1H3,(H,7,10)(H2,8,9,11).
What are the key properties of N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide?
N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 155.16 g/mol, XLogP of -0.55, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-oxo-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 23629745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).