2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide

C8H12N4O2 — CID 62378989

IUPAC2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(NC1CCNC1)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C8H12N4O2/c13-7(6-4-10-8(14)12-6)11-5-1-2-9-3-5/h4-5,9H,1-3H2,(H,11,13)(H2,10,12,14)
InChIKeySLZLUWYPUHMEEQ-UHFFFAOYSA-N
MW196.21 g/mol
LogP-1.21
Rot. Bonds2

About 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide

2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide (PubChem CID 62378989) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
PubChem CID62378989
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(NC1CCNC1)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C8H12N4O2/c13-7(6-4-10-8(14)12-6)11-5-1-2-9-3-5/h4-5,9H,1-3H2,(H,11,13)(H2,10,12,14)
InChIKeySLZLUWYPUHMEEQ-UHFFFAOYSA-N
XLogP-1.21
TPSA89.78 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-1.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide (CID 62378989) is 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide is O=C(NC1CCNC1)c1c[nH]c(=O)[nH]1.
What is the InChIKey of 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is SLZLUWYPUHMEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c13-7(6-4-10-8(14)12-6)11-5-1-2-9-3-5/h4-5,9H,1-3H2,(H,11,13)(H2,10,12,14).
What are the key properties of 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 196.21 g/mol, XLogP of -1.21, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 62378989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).