1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide

C12H16N8O — CID 80729329

IUPAC1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2nc(N)nc(-n3cccn3)n2)CC1
InChIInChI=1S/C12H16N8O/c13-9(21)8-2-6-19(7-3-8)11-16-10(14)17-12(18-11)20-5-1-4-15-20/h1,4-5,8H,2-3,6-7H2,(H2,13,21)(H2,14,16,17,18)
InChIKeyLKSIOAGJJBQNKJ-UHFFFAOYSA-N
MW288.31 g/mol
LogP-0.66
Rot. Bonds3

About 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide

1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide (PubChem CID 80729329) has the molecular formula C12H16N8O and a molecular weight of 288.31 g/mol. Its IUPAC name is 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide
PubChem CID80729329
Molecular FormulaC12H16N8O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC Name1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2nc(N)nc(-n3cccn3)n2)CC1
InChIInChI=1S/C12H16N8O/c13-9(21)8-2-6-19(7-3-8)11-16-10(14)17-12(18-11)20-5-1-4-15-20/h1,4-5,8H,2-3,6-7H2,(H2,13,21)(H2,14,16,17,18)
InChIKeyLKSIOAGJJBQNKJ-UHFFFAOYSA-N
XLogP-0.66
TPSA128.84 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidin-4-ol
CID 80764921
4-piperidin-1-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80765065
4-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperazine-2,6-dione
CID 80855646
4-(3-methoxy-4-methylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 102971465
[1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidin-2-yl]methanol
CID 80794266
1-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)azepane
CID 62869697
1-(4-amino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)pyrazole-4-carboxamide
CID 80868517
2-chloro-4-(4-propan-2-ylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazine
CID 103500945
2-N-(cyclobutylmethyl)-6-pyrazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80784120
1-[4-(3-hydroxypyrrolidin-1-yl)pyrimidin-2-yl]piperidine-4-carboxamide
CID 50982280
6-pyrazol-1-yl-2-N-(2-pyrrolidin-1-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80832241
1-(6-pyrazol-1-ylpyrazin-2-yl)piperidine-4-carboxylic acid
CID 146134490

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide (CID 80729329) is 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide is NC(=O)C1CCN(c2nc(N)nc(-n3cccn3)n2)CC1.
What is the InChIKey of 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The InChIKey is LKSIOAGJJBQNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N8O/c13-9(21)8-2-6-19(7-3-8)11-16-10(14)17-12(18-11)20-5-1-4-15-20/h1,4-5,8H,2-3,6-7H2,(H2,13,21)(H2,14,16,17,18).
What are the key properties of 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide has a molecular weight of 288.31 g/mol, XLogP of -0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 80729329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).