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

C9H14N4O2 — CID 63297697

IUPACN-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
SMILESCN(C(=O)c1c[nH]c(=O)[nH]1)C1CCNC1
InChIInChI=1S/C9H14N4O2/c1-13(6-2-3-10-4-6)8(14)7-5-11-9(15)12-7/h5-6,10H,2-4H2,1H3,(H2,11,12,15)
InChIKeyPHUHZMMRSTZRPI-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.86
Rot. Bonds2

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

N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide (PubChem CID 63297697) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
PubChem CID63297697
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC NameN-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
SMILESCN(C(=O)c1c[nH]c(=O)[nH]1)C1CCNC1
InChIInChI=1S/C9H14N4O2/c1-13(6-2-3-10-4-6)8(14)7-5-11-9(15)12-7/h5-6,10H,2-4H2,1H3,(H2,11,12,15)
InChIKeyPHUHZMMRSTZRPI-UHFFFAOYSA-N
XLogP-0.86
TPSA80.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide (CID 63297697) is N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide is CN(C(=O)c1c[nH]c(=O)[nH]1)C1CCNC1.
What is the InChIKey of N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is PHUHZMMRSTZRPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-13(6-2-3-10-4-6)8(14)7-5-11-9(15)12-7/h5-6,10H,2-4H2,1H3,(H2,11,12,15).
What are the key properties of N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide?
N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 210.24 g/mol, XLogP of -0.86, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 63297697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).