4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide

C6H7N3O3 — CID 58103684

IUPAC4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide
SMILESCNC(=O)c1nc(O)cc(=O)[nH]1
InChIInChI=1S/C6H7N3O3/c1-7-6(12)5-8-3(10)2-4(11)9-5/h2H,1H3,(H,7,12)(H2,8,9,10,11)
InChIKeyCVFFXBXNFNHRCK-UHFFFAOYSA-N
MW169.14 g/mol
LogP-1.16
Rot. Bonds1

About 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide

4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide (PubChem CID 58103684) has the molecular formula C6H7N3O3 and a molecular weight of 169.14 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide
PubChem CID58103684
Molecular FormulaC6H7N3O3
Molecular Weight169.14 g/mol
Exact Mass169.05
IUPAC Name4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide
SMILESCNC(=O)c1nc(O)cc(=O)[nH]1
InChIInChI=1S/C6H7N3O3/c1-7-6(12)5-8-3(10)2-4(11)9-5/h2H,1H3,(H,7,12)(H2,8,9,10,11)
InChIKeyCVFFXBXNFNHRCK-UHFFFAOYSA-N
XLogP-1.16
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.14
LogP ≤ 5-1.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide (CID 58103684) is 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide is CNC(=O)c1nc(O)cc(=O)[nH]1.
What is the InChIKey of 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide?
The InChIKey is CVFFXBXNFNHRCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3/c1-7-6(12)5-8-3(10)2-4(11)9-5/h2H,1H3,(H,7,12)(H2,8,9,10,11).
What are the key properties of 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide?
4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide has a molecular weight of 169.14 g/mol, XLogP of -1.16, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-6-oxo-1H-pyrimidine-2-carboxamide is sourced from PubChem (CID 58103684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).