2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide

C19H18F3N5O2 — CID 134489494

IUPAC2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide
SMILESCNC(=O)c1c(C)ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)cc(=O)n12
InChIInChI=1S/C19H18F3N5O2/c1-10-3-6-15-24-12(7-16(28)27(15)17(10)18(29)23-2)9-26-13(11-4-5-11)8-14(25-26)19(20,21)22/h3,6-8,11H,4-5,9H2,1-2H3,(H,23,29)
InChIKeyGWRFUZNYFIIXBN-UHFFFAOYSA-N
MW405.38 g/mol
LogP2.50
Rot. Bonds4

About 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide

2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide (PubChem CID 134489494) has the molecular formula C19H18F3N5O2 and a molecular weight of 405.38 g/mol. Its IUPAC name is 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide
PubChem CID134489494
Molecular FormulaC19H18F3N5O2
Molecular Weight405.38 g/mol
Exact Mass405.14
IUPAC Name2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide
SMILESCNC(=O)c1c(C)ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)cc(=O)n12
InChIInChI=1S/C19H18F3N5O2/c1-10-3-6-15-24-12(7-16(28)27(15)17(10)18(29)23-2)9-26-13(11-4-5-11)8-14(25-26)19(20,21)22/h3,6-8,11H,4-5,9H2,1-2H3,(H,23,29)
InChIKeyGWRFUZNYFIIXBN-UHFFFAOYSA-N
XLogP2.50
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide (CID 134489494) is 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide is CNC(=O)c1c(C)ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)cc(=O)n12.
What is the InChIKey of 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide?
The InChIKey is GWRFUZNYFIIXBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3N5O2/c1-10-3-6-15-24-12(7-16(28)27(15)17(10)18(29)23-2)9-26-13(11-4-5-11)8-14(25-26)19(20,21)22/h3,6-8,11H,4-5,9H2,1-2H3,(H,23,29).
What are the key properties of 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide?
2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide has a molecular weight of 405.38 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-N,7-dimethyl-4-oxopyrido[1,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 134489494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).