5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide

C14H11N5O4 — CID 146664900

IUPAC5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide
SMILESCn1c(-c2ccccn2)nc(C(=O)Nc2cnoc2)c(O)c1=O
InChIInChI=1S/C14H11N5O4/c1-19-12(9-4-2-3-5-15-9)18-10(11(20)14(19)22)13(21)17-8-6-16-23-7-8/h2-7,20H,1H3,(H,17,21)
InChIKeyBIVIOPPGQWNZCE-UHFFFAOYSA-N
MW313.27 g/mol
LogP0.79
Rot. Bonds3

About 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide

5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide (PubChem CID 146664900) has the molecular formula C14H11N5O4 and a molecular weight of 313.27 g/mol. Its IUPAC name is 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide
PubChem CID146664900
Molecular FormulaC14H11N5O4
Molecular Weight313.27 g/mol
Exact Mass313.08
IUPAC Name5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide
SMILESCn1c(-c2ccccn2)nc(C(=O)Nc2cnoc2)c(O)c1=O
InChIInChI=1S/C14H11N5O4/c1-19-12(9-4-2-3-5-15-9)18-10(11(20)14(19)22)13(21)17-8-6-16-23-7-8/h2-7,20H,1H3,(H,17,21)
InChIKeyBIVIOPPGQWNZCE-UHFFFAOYSA-N
XLogP0.79
TPSA123.14 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.27
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide?
The IUPAC name of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide (CID 146664900) is 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide is Cn1c(-c2ccccn2)nc(C(=O)Nc2cnoc2)c(O)c1=O.
What is the InChIKey of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide?
The InChIKey is BIVIOPPGQWNZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O4/c1-19-12(9-4-2-3-5-15-9)18-10(11(20)14(19)22)13(21)17-8-6-16-23-7-8/h2-7,20H,1H3,(H,17,21).
What are the key properties of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide?
5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide has a molecular weight of 313.27 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 146664900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).