3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide

C20H16N4O3S — CID 67397380

IUPAC3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide
SMILESCOc1ccccc1C(=O)Nc1[nH]nc2sc(C(=O)Nc3ccccc3)cc12
InChIInChI=1S/C20H16N4O3S/c1-27-15-10-6-5-9-13(15)18(25)22-17-14-11-16(28-20(14)24-23-17)19(26)21-12-7-3-2-4-8-12/h2-11H,1H3,(H,21,26)(H2,22,23,24,25)
InChIKeyKXONAWYWUDBGBK-UHFFFAOYSA-N
MW392.44 g/mol
LogP4.14
Rot. Bonds5

About 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide

3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide (PubChem CID 67397380) has the molecular formula C20H16N4O3S and a molecular weight of 392.44 g/mol. Its IUPAC name is 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide
PubChem CID67397380
Molecular FormulaC20H16N4O3S
Molecular Weight392.44 g/mol
Exact Mass392.09
IUPAC Name3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide
SMILESCOc1ccccc1C(=O)Nc1[nH]nc2sc(C(=O)Nc3ccccc3)cc12
InChIInChI=1S/C20H16N4O3S/c1-27-15-10-6-5-9-13(15)18(25)22-17-14-11-16(28-20(14)24-23-17)19(26)21-12-7-3-2-4-8-12/h2-11H,1H3,(H,21,26)(H2,22,23,24,25)
InChIKeyKXONAWYWUDBGBK-UHFFFAOYSA-N
XLogP4.14
TPSA96.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.44
LogP ≤ 54.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-chlorobenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67401659
N-(3-methoxyphenyl)-3-[(2-phenylacetyl)amino]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67398184
3-[[2-[(4-methoxybenzoyl)amino]benzoyl]amino]-2H-thieno[2,3-c]pyrazole-5-carboxylic acid
CID 68823372
N-(2-methoxyphenyl)-3-[[2-(2-methylphenyl)acetyl]amino]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67397393
3-benzamido-N-propan-2-yl-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67398673
N-(4-chlorophenyl)-3-[(4-methylbenzoyl)amino]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67399374
N-tert-butyl-3-[(2-fluorobenzoyl)amino]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67401377
3-[[2-(2-chlorophenyl)acetyl]amino]-N-[(2-methoxyphenyl)methyl]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67399257
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 7741659
N-(2-phenylpropan-2-yl)-3-[[2-(thiophene-2-carbonylamino)benzoyl]amino]-2H-thieno[2,3-c]pyrazole-5-carboxamide
CID 67158470
3-[[2-[(1-methylimidazole-2-carbonyl)amino]benzoyl]amino]-2H-thieno[2,3-c]pyrazole-5-carboxylic acid
CID 68821556
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide?
The IUPAC name of 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide (CID 67397380) is 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide.
What is the SMILES notation for 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide?
The canonical SMILES for 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide is COc1ccccc1C(=O)Nc1[nH]nc2sc(C(=O)Nc3ccccc3)cc12.
What is the InChIKey of 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide?
The InChIKey is KXONAWYWUDBGBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O3S/c1-27-15-10-6-5-9-13(15)18(25)22-17-14-11-16(28-20(14)24-23-17)19(26)21-12-7-3-2-4-8-12/h2-11H,1H3,(H,21,26)(H2,22,23,24,25).
What are the key properties of 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide?
3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide has a molecular weight of 392.44 g/mol, XLogP of 4.14, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxybenzoyl)amino]-N-phenyl-2H-thieno[2,3-c]pyrazole-5-carboxamide is sourced from PubChem (CID 67397380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).