N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide

C17H16N4O3 — CID 3737424

IUPACN-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(-n3cccn3)nc2)c1
InChIInChI=1S/C17H16N4O3/c1-23-13-5-6-15(24-2)14(10-13)20-17(22)12-4-7-16(18-11-12)21-9-3-8-19-21/h3-11H,1-2H3,(H,20,22)
InChIKeyBLJSCFDMIUARLV-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.54
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide

N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide (PubChem CID 3737424) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
PubChem CID3737424
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC NameN-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(-n3cccn3)nc2)c1
InChIInChI=1S/C17H16N4O3/c1-23-13-5-6-15(24-2)14(10-13)20-17(22)12-4-7-16(18-11-12)21-9-3-8-19-21/h3-11H,1-2H3,(H,20,22)
InChIKeyBLJSCFDMIUARLV-UHFFFAOYSA-N
XLogP2.54
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2,5-dimethoxyphenyl)-6-pyrazol-1-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 N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide (CID 3737424) is N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(-n3cccn3)nc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The InChIKey is BLJSCFDMIUARLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-23-13-5-6-15(24-2)14(10-13)20-17(22)12-4-7-16(18-11-12)21-9-3-8-19-21/h3-11H,1-2H3,(H,20,22).
What are the key properties of N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 3737424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).