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

C19H23N5O2 — CID 46988115

IUPAC4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nn(C)c(C)c1CN(C(=O)c1cnc2ccccn2c1=O)C(C)C
InChIInChI=1S/C19H23N5O2/c1-12(2)24(11-16-13(3)21-22(5)14(16)4)19(26)15-10-20-17-8-6-7-9-23(17)18(15)25/h6-10,12H,11H2,1-5H3
InChIKeyOLCDKHRKFHVQRS-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.10
Rot. Bonds4

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

4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 46988115) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID46988115
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nn(C)c(C)c1CN(C(=O)c1cnc2ccccn2c1=O)C(C)C
InChIInChI=1S/C19H23N5O2/c1-12(2)24(11-16-13(3)21-22(5)14(16)4)19(26)15-10-20-17-8-6-7-9-23(17)18(15)25/h6-10,12H,11H2,1-5H3
InChIKeyOLCDKHRKFHVQRS-UHFFFAOYSA-N
XLogP2.10
TPSA72.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

5-chloro-2-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1H-pyridine-3-carboxamide
CID 46989245
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-hydroxy-N-(2-methoxyethyl)-2-methylpyrimidine-5-carboxamide
CID 72884537
2-(3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl)-8-fluoro-3,4-dihydro-1H-dipyrido[1,2-a:4',3'-d]pyrimidin-11(2H)-one
CID 91632581
2-[3,5-dimethyl-1-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]-4-methyl-1H-pyrimidin-6-one
CID 137049228
1-ethyl-5-({methyl[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]amino}methyl)pyridin-2(1H)-one
CID 53191755
7-[(1-Ethyl-3,5-dimethylpyrazol-4-yl)methyl]-2,5,6,8-tetrahydro-2,7-naphthyridin-1-one
CID 132307157
1-(2-Cyclohexylimino-1-pyridinyl)-2-[1-(difluoromethyl)-3,5-dimethylpyrazol-4-yl]ethanone
CID 48655511
N-isopropyl-1-methyl-6-oxo-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,6-dihydropyridine-3-carboxamide
CID 50968934
N-(1,3-dimethyl-4,5,6,7-tetrahydro-1H-indazol-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
CID 145936960
1-Cyclohexa-1,3-dien-1-yl-5-(1,3,5-trimethylpyrazol-4-yl)pyridin-2-one
CID 118680512
4-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrido[1,2-a]pyrimidine-3-carboxamide
CID 24675460
2-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrimidin-6-one
CID 43654657

Frequently Asked Questions

What is the IUPAC name of 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide (CID 46988115) is 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide is Cc1nn(C)c(C)c1CN(C(=O)c1cnc2ccccn2c1=O)C(C)C.
What is the InChIKey of 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is OLCDKHRKFHVQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-12(2)24(11-16-13(3)21-22(5)14(16)4)19(26)15-10-20-17-8-6-7-9-23(17)18(15)25/h6-10,12H,11H2,1-5H3.
What are the key properties of 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide?
4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 2.10, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N-propan-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 46988115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).