N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

C14H20N6O — CID 46981642

IUPACN-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)c1nc2ncccn2n1
InChIInChI=1S/C14H20N6O/c1-18(10-11-19-7-3-2-4-8-19)13(21)12-16-14-15-6-5-9-20(14)17-12/h5-6,9H,2-4,7-8,10-11H2,1H3
InChIKeyFFQNAWDFNVXYLP-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.68
Rot. Bonds4

About N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 46981642) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID46981642
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC NameN-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)c1nc2ncccn2n1
InChIInChI=1S/C14H20N6O/c1-18(10-11-19-7-3-2-4-8-19)13(21)12-16-14-15-6-5-9-20(14)17-12/h5-6,9H,2-4,7-8,10-11H2,1H3
InChIKeyFFQNAWDFNVXYLP-UHFFFAOYSA-N
XLogP0.68
TPSA66.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-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-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 46981642) is N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is CN(CCN1CCCCC1)C(=O)c1nc2ncccn2n1.
What is the InChIKey of N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is FFQNAWDFNVXYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-18(10-11-19-7-3-2-4-8-19)13(21)12-16-14-15-6-5-9-20(14)17-12/h5-6,9H,2-4,7-8,10-11H2,1H3.
What are the key properties of N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 46981642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).