N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide

C20H15N3OS — CID 11371383

IUPACN-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide
SMILESO=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccsc1
InChIInChI=1S/C20H15N3OS/c24-20(16-11-12-25-14-16)21-19-13-18(15-7-3-1-4-8-15)22-23(19)17-9-5-2-6-10-17/h1-14H,(H,21,24)
InChIKeyDQKXGDKZDMLTJK-UHFFFAOYSA-N
MW345.43 g/mol
LogP4.85
Rot. Bonds4

About N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide

N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide (PubChem CID 11371383) has the molecular formula C20H15N3OS and a molecular weight of 345.43 g/mol. Its IUPAC name is N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide
PubChem CID11371383
Molecular FormulaC20H15N3OS
Molecular Weight345.43 g/mol
Exact Mass345.09
IUPAC NameN-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide
SMILESO=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccsc1
InChIInChI=1S/C20H15N3OS/c24-20(16-11-12-25-14-16)21-19-13-18(15-7-3-1-4-8-15)22-23(19)17-9-5-2-6-10-17/h1-14H,(H,21,24)
InChIKeyDQKXGDKZDMLTJK-UHFFFAOYSA-N
XLogP4.85
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.43
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 4156919
Thiophene-2-carboxylic acid (2,5-diphenyl-2H-pyrazol-3-yl)-amide
CID 11152155
N-(1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)-2-(methylthio)benzamide
CID 135551751
2-(thiophen-2-yl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135939587
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-3-methylsulfanylbenzamide
CID 156208585
N-[2-[[1-(2-cyanoethyl)-3-phenylpyrazol-5-yl]amino]phenyl]thiophene-2-carboxamide
CID 2997935
N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]thiophene-2-carboxamide
CID 3235680
N-(2-(2,4-dimethylphenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide
CID 5070030
N-(1,3-diphenyl-1H-pyrazol-5-yl)-4-(methylsulfonyl)benzamide
CID 25102663
3-Methyl-1-(4-methylphenyl)-4-(thiophen-3-YL)-1H,4H,6H,7H,8H-pyrazolo[3,4-E][1,4]thiazepin-7-one
CID 135823711
3-[(1,3-Diphenylpyrazol-5-yl)amino]-1-thiophen-2-ylprop-2-en-1-one
CID 164617385
N-(1-methyl-3-phenyl-1H-pyrazol-5-yl)-2-thiophenecarboxamide
CID 2814958

Frequently Asked Questions

What is the IUPAC name of N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide?
The IUPAC name of N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide (CID 11371383) is N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide.
What is the SMILES notation for N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide?
The canonical SMILES for N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide is O=C(Nc1cc(-c2ccccc2)nn1-c1ccccc1)c1ccsc1.
What is the InChIKey of N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide?
The InChIKey is DQKXGDKZDMLTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3OS/c24-20(16-11-12-25-14-16)21-19-13-18(15-7-3-1-4-8-15)22-23(19)17-9-5-2-6-10-17/h1-14H,(H,21,24).
What are the key properties of N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide?
N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide has a molecular weight of 345.43 g/mol, XLogP of 4.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-diphenylpyrazol-5-yl)thiophene-3-carboxamide is sourced from PubChem (CID 11371383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).