4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide

C15H15N5O2 — CID 24675460

IUPAC4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nn(C)c(C)c1NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H15N5O2/c1-9-13(10(2)19(3)18-9)17-14(21)11-8-16-12-6-4-5-7-20(12)15(11)22/h4-8H,1-3H3,(H,17,21)
InChIKeyLEDLBIXFLYXPRJ-UHFFFAOYSA-N
MW297.32 g/mol
LogP1.30
Rot. Bonds2

About 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide

4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 24675460) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID24675460
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nn(C)c(C)c1NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H15N5O2/c1-9-13(10(2)19(3)18-9)17-14(21)11-8-16-12-6-4-5-7-20(12)15(11)22/h4-8H,1-3H3,(H,17,21)
InChIKeyLEDLBIXFLYXPRJ-UHFFFAOYSA-N
XLogP1.30
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide (CID 24675460) is 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide is Cc1nn(C)c(C)c1NC(=O)c1cnc2ccccn2c1=O.
What is the InChIKey of 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is LEDLBIXFLYXPRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-9-13(10(2)19(3)18-9)17-14(21)11-8-16-12-6-4-5-7-20(12)15(11)22/h4-8H,1-3H3,(H,17,21).
What are the key properties of 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide?
4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 297.32 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 24675460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).