5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide

C15H15N7O2 — CID 137128031

IUPAC5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide
SMILESCc1cc(=O)[nH]c(-n2ncc(C(=O)NCc3cnccn3)c2C)n1
InChIInChI=1S/C15H15N7O2/c1-9-5-13(23)21-15(20-9)22-10(2)12(8-19-22)14(24)18-7-11-6-16-3-4-17-11/h3-6,8H,7H2,1-2H3,(H,18,24)(H,20,21,23)
InChIKeyIJKCWMRSQBOVJR-UHFFFAOYSA-N
MW325.33 g/mol
LogP0.29
Rot. Bonds4

About 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide

5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide (PubChem CID 137128031) has the molecular formula C15H15N7O2 and a molecular weight of 325.33 g/mol. Its IUPAC name is 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide
PubChem CID137128031
Molecular FormulaC15H15N7O2
Molecular Weight325.33 g/mol
Exact Mass325.13
IUPAC Name5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide
SMILESCc1cc(=O)[nH]c(-n2ncc(C(=O)NCc3cnccn3)c2C)n1
InChIInChI=1S/C15H15N7O2/c1-9-5-13(23)21-15(20-9)22-10(2)12(8-19-22)14(24)18-7-11-6-16-3-4-17-11/h3-6,8H,7H2,1-2H3,(H,18,24)(H,20,21,23)
InChIKeyIJKCWMRSQBOVJR-UHFFFAOYSA-N
XLogP0.29
TPSA118.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide
CID 137049118
2-[4-[2-(7-azabicyclo[2.2.1]heptan-7-yl)acetyl]-5-methylpyrazol-1-yl]-4-methyl-1H-pyrimidin-6-one
CID 137128030
N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-propan-2-ylpyrazole-4-carboxamide
CID 137049041
4-methyl-2-[5-methyl-4-(2-methyl-2,3-dihydroindole-1-carbonyl)pyrazol-1-yl]-1H-pyrimidin-6-one
CID 137049037
5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-4-carbaldehyde
CID 145286916
5-methyl-N-[(1-methyl-3-pyrazin-2-ylpyrazol-5-yl)methyl]-1-phenylpyrazole-4-carboxamide
CID 121020006
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 137150738
1-(2-chlorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazole-4-carboxamide
CID 42818120
4-amino-3-methyl-N-(pyrazin-2-ylmethyl)benzamide
CID 110476152
6-ethyl-N-(pyrazin-2-ylmethyl)quinoline-8-carboxamide
CID 175792326
2-oxo-N-(pyrazin-2-ylmethyl)acetamide
CID 90048439
N-[[4-(methanesulfonamidomethyl)-2-pyridinyl]methyl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 157015006

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide (CID 137128031) is 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide is Cc1cc(=O)[nH]c(-n2ncc(C(=O)NCc3cnccn3)c2C)n1.
What is the InChIKey of 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide?
The InChIKey is IJKCWMRSQBOVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7O2/c1-9-5-13(23)21-15(20-9)22-10(2)12(8-19-22)14(24)18-7-11-6-16-3-4-17-11/h3-6,8H,7H2,1-2H3,(H,18,24)(H,20,21,23).
What are the key properties of 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide?
5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide has a molecular weight of 325.33 g/mol, XLogP of 0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 137128031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).