4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide

C13H10N4OS — CID 110464300

IUPAC4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1ccc(-c2cn[nH]c2)cc1
InChIInChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)10-3-1-9(2-4-10)11-7-15-16-8-11/h1-8H,(H,15,16)(H,14,17,18)
InChIKeyIDZXVGBESGDXQI-UHFFFAOYSA-N
MW270.32 g/mol
LogP2.79
Rot. Bonds3

About 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide

4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 110464300) has the molecular formula C13H10N4OS and a molecular weight of 270.32 g/mol. Its IUPAC name is 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID110464300
Molecular FormulaC13H10N4OS
Molecular Weight270.32 g/mol
Exact Mass270.06
IUPAC Name4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1ccc(-c2cn[nH]c2)cc1
InChIInChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)10-3-1-9(2-4-10)11-7-15-16-8-11/h1-8H,(H,15,16)(H,14,17,18)
InChIKeyIDZXVGBESGDXQI-UHFFFAOYSA-N
XLogP2.79
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-2-pyridinyl)-4-(1H-pyrazol-4-yl)benzamide
CID 110464333
4-(4-methylphenoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 16651068
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361308
4-propan-2-yloxy-N-(1,3-thiazol-2-yl)benzamide
CID 762358
N-(1,3-thiazol-2-yl)-2H-benzotriazole-5-carboxamide
CID 18276930
2-fluoro-4-[6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-(1,3-thiazol-2-yl)benzamide;dihydrochloride
CID 87901707
N-ethyl-4-(1H-pyrazol-4-yl)benzamide
CID 110464248
6-(methylamino)-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62171449
4-(2-phenylethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 4956346
4-ethylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
CID 7295292
6-piperidin-4-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 110085479

Frequently Asked Questions

What is the IUPAC name of 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide (CID 110464300) is 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide is O=C(Nc1nccs1)c1ccc(-c2cn[nH]c2)cc1.
What is the InChIKey of 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is IDZXVGBESGDXQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)10-3-1-9(2-4-10)11-7-15-16-8-11/h1-8H,(H,15,16)(H,14,17,18).
What are the key properties of 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide?
4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 270.32 g/mol, XLogP of 2.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 110464300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).