N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C19H25N3O2 — CID 136520236

IUPACN-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCCC1CCC(N(C)C(=O)c2cnc3c(C)cccn3c2=O)CC1
InChIInChI=1S/C19H25N3O2/c1-4-14-7-9-15(10-8-14)21(3)18(23)16-12-20-17-13(2)6-5-11-22(17)19(16)24/h5-6,11-12,14-15H,4,7-10H2,1-3H3
InChIKeySUEQYINMMIVVKZ-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.04
Rot. Bonds3

About N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 136520236) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID136520236
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCCC1CCC(N(C)C(=O)c2cnc3c(C)cccn3c2=O)CC1
InChIInChI=1S/C19H25N3O2/c1-4-14-7-9-15(10-8-14)21(3)18(23)16-12-20-17-13(2)6-5-11-22(17)19(16)24/h5-6,11-12,14-15H,4,7-10H2,1-3H3
InChIKeySUEQYINMMIVVKZ-UHFFFAOYSA-N
XLogP3.04
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-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 N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 136520236) is N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is CCC1CCC(N(C)C(=O)c2cnc3c(C)cccn3c2=O)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is SUEQYINMMIVVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-4-14-7-9-15(10-8-14)21(3)18(23)16-12-20-17-13(2)6-5-11-22(17)19(16)24/h5-6,11-12,14-15H,4,7-10H2,1-3H3.
What are the key properties of N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-N,9-dimethyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 136520236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).