4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide

C10H11BrN4O3S2 — CID 17022601

IUPAC4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide
SMILESCNC(=O)c1nn(C)cc1NS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C10H11BrN4O3S2/c1-12-10(16)9-6(5-15(2)13-9)14-20(17,18)8-4-3-7(11)19-8/h3-5,14H,1-2H3,(H,12,16)
InChIKeyRFBWHGUCPNAYHP-UHFFFAOYSA-N
MW379.26 g/mol
LogP1.40
Rot. Bonds4

About 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide

4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide (PubChem CID 17022601) has the molecular formula C10H11BrN4O3S2 and a molecular weight of 379.26 g/mol. Its IUPAC name is 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide
PubChem CID17022601
Molecular FormulaC10H11BrN4O3S2
Molecular Weight379.26 g/mol
Exact Mass377.95
IUPAC Name4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide
SMILESCNC(=O)c1nn(C)cc1NS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C10H11BrN4O3S2/c1-12-10(16)9-6(5-15(2)13-9)14-20(17,18)8-4-3-7(11)19-8/h3-5,14H,1-2H3,(H,12,16)
InChIKeyRFBWHGUCPNAYHP-UHFFFAOYSA-N
XLogP1.40
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.26
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-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

Related Compounds

2-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylbenzamide
CID 26268701
4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide
CID 19582232
3-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylbenzamide
CID 31580807
5-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]thiophene-2-sulfonamide
CID 19575260
4-[(4-bromothiophene-2-carbonyl)amino]-N,1-dimethylpyrazole-3-carboxamide
CID 17024416
4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19410625
5-bromo-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
CID 22773592
4-[(2-chloroacetyl)amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19410660
5-bromo-N-(2-bromo-4-methylphenyl)thiophene-2-sulfonamide
CID 22773978
5-bromo-N-(4-bromo-2,5-difluorophenyl)thiophene-2-sulfonamide
CID 103844048
methyl 3-[(5-bromothiophen-2-yl)sulfonylamino]-4-methylbenzoate
CID 1006764
3-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylpropanamide
CID 61060598

Frequently Asked Questions

What is the IUPAC name of 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide?
The IUPAC name of 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide (CID 17022601) is 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide?
The canonical SMILES for 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide is CNC(=O)c1nn(C)cc1NS(=O)(=O)c1ccc(Br)s1.
What is the InChIKey of 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide?
The InChIKey is RFBWHGUCPNAYHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4O3S2/c1-12-10(16)9-6(5-15(2)13-9)14-20(17,18)8-4-3-7(11)19-8/h3-5,14H,1-2H3,(H,12,16).
What are the key properties of 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide?
4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide has a molecular weight of 379.26 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-bromothiophen-2-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 17022601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).