2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide

C20H16N6O — CID 71060882

IUPAC2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide
SMILESNc1ncc(-c2ccc(-n3cccn3)cc2)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C20H16N6O/c21-19-18(20(27)25-16-6-9-22-10-7-16)12-15(13-23-19)14-2-4-17(5-3-14)26-11-1-8-24-26/h1-13H,(H2,21,23)(H,22,25,27)
InChIKeyRRQPRTMYJUAVMC-UHFFFAOYSA-N
MW356.39 g/mol
LogP3.16
Rot. Bonds4

About 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide

2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide (PubChem CID 71060882) has the molecular formula C20H16N6O and a molecular weight of 356.39 g/mol. Its IUPAC name is 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide
PubChem CID71060882
Molecular FormulaC20H16N6O
Molecular Weight356.39 g/mol
Exact Mass356.14
IUPAC Name2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide
SMILESNc1ncc(-c2ccc(-n3cccn3)cc2)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C20H16N6O/c21-19-18(20(27)25-16-6-9-22-10-7-16)12-15(13-23-19)14-2-4-17(5-3-14)26-11-1-8-24-26/h1-13H,(H2,21,23)(H,22,25,27)
InChIKeyRRQPRTMYJUAVMC-UHFFFAOYSA-N
XLogP3.16
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-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 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide?
The IUPAC name of 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide (CID 71060882) is 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide is Nc1ncc(-c2ccc(-n3cccn3)cc2)cc1C(=O)Nc1ccncc1.
What is the InChIKey of 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide?
The InChIKey is RRQPRTMYJUAVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O/c21-19-18(20(27)25-16-6-9-22-10-7-16)12-15(13-23-19)14-2-4-17(5-3-14)26-11-1-8-24-26/h1-13H,(H2,21,23)(H,22,25,27).
What are the key properties of 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide?
2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide has a molecular weight of 356.39 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(4-pyrazol-1-ylphenyl)-N-pyridin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 71060882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).