N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide

C20H16N6O — CID 59376314

IUPACN-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Nc2cn[nH]c2-c2ccccn2)nc1)c1ccccc1
InChIInChI=1S/C20H16N6O/c27-20(14-6-2-1-3-7-14)24-15-9-10-18(22-12-15)25-17-13-23-26-19(17)16-8-4-5-11-21-16/h1-13H,(H,22,25)(H,23,26)(H,24,27)
InChIKeyZFWXQZXWDUTTRH-UHFFFAOYSA-N
MW356.39 g/mol
LogP3.86
Rot. Bonds5

About N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide

N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide (PubChem CID 59376314) has the molecular formula C20H16N6O and a molecular weight of 356.39 g/mol. Its IUPAC name is N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide
PubChem CID59376314
Molecular FormulaC20H16N6O
Molecular Weight356.39 g/mol
Exact Mass356.14
IUPAC NameN-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Nc2cn[nH]c2-c2ccccn2)nc1)c1ccccc1
InChIInChI=1S/C20H16N6O/c27-20(14-6-2-1-3-7-14)24-15-9-10-18(22-12-15)25-17-13-23-26-19(17)16-8-4-5-11-21-16/h1-13H,(H,22,25)(H,23,26)(H,24,27)
InChIKeyZFWXQZXWDUTTRH-UHFFFAOYSA-N
XLogP3.86
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 53.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-2,5-diamine
CID 59376329
6-(ethylamino)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166397794
2-tert-butyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyrimidine-5-carboxamide
CID 166225176
2-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
CID 146124376
4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
CID 167793596
N-[6-(4-phenoxyanilino)-3-pyridinyl]benzamide
CID 113021208
4-methyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166192549
4-fluoro-N-[6-(2-phenoxyanilino)-3-pyridinyl]benzamide
CID 113021986
5-ethyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166234581
5-pyridin-2-yl-1H-pyrazole-4-carboxylic acid;dihydrochloride
CID 121229973
4-chloro-N-[6-(2-chloroanilino)-3-pyridinyl]benzamide
CID 113018439
N-[6-(2,6-diethylanilino)-3-pyridinyl]benzamide
CID 113017964

Frequently Asked Questions

What is the IUPAC name of N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide?
The IUPAC name of N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide (CID 59376314) is N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide.
What is the SMILES notation for N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide?
The canonical SMILES for N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide is O=C(Nc1ccc(Nc2cn[nH]c2-c2ccccn2)nc1)c1ccccc1.
What is the InChIKey of N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide?
The InChIKey is ZFWXQZXWDUTTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O/c27-20(14-6-2-1-3-7-14)24-15-9-10-18(22-12-15)25-17-13-23-26-19(17)16-8-4-5-11-21-16/h1-13H,(H,22,25)(H,23,26)(H,24,27).
What are the key properties of N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide?
N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide has a molecular weight of 356.39 g/mol, XLogP of 3.86, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]-3-pyridinyl]benzamide is sourced from PubChem (CID 59376314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).