N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

C16H16ClN3O3S — CID 9362162

IUPACN-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)NCc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C16H16ClN3O3S/c1-10-16(11(2)20-19-10)24(21,22)18-9-14-7-8-15(23-14)12-3-5-13(17)6-4-12/h3-8,18H,9H2,1-2H3,(H,19,20)
InChIKeyJWIGCWBJLIPZPI-UHFFFAOYSA-N
MW365.84 g/mol
LogP3.42
Rot. Bonds5

About N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 9362162) has the molecular formula C16H16ClN3O3S and a molecular weight of 365.84 g/mol. Its IUPAC name is N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
PubChem CID9362162
Molecular FormulaC16H16ClN3O3S
Molecular Weight365.84 g/mol
Exact Mass365.06
IUPAC NameN-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)NCc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C16H16ClN3O3S/c1-10-16(11(2)20-19-10)24(21,22)18-9-14-7-8-15(23-14)12-3-5-13(17)6-4-12/h3-8,18H,9H2,1-2H3,(H,19,20)
InChIKeyJWIGCWBJLIPZPI-UHFFFAOYSA-N
XLogP3.42
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.84
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide 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

N-[5-(5-tert-butyl-2-methylfuran-3-yl)-1H-pyrazol-3-yl]-4-chlorobenzenesulfonamide
CID 2742271
5-(3,4-Dimethyl-1H-pyrazol-5-YL)-N-[(5-methylfuran-2-YL)methyl]furan-2-sulfonamide
CID 53075755
5-(3,4-dimethyl-1H-pyrazol-5-yl)-N-(4-methylcyclohexyl)furan-2-sulfonamide
CID 53075753
N-[(2S)-butan-2-yl]-5-(4,5-dimethyl-1H-pyrazol-3-yl)furan-2-sulfonamide
CID 92889830
1-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-4-[3-(furan-2-yl)-1H-pyrazol-5-yl]piperidine
CID 5159139
N-(4-chloro-2-methylphenyl)-5-(3-methyl-1H-pyrazol-5-yl)furan-2-sulfonamide
CID 46329417
N-(2-chloro-4-methylphenyl)-5-(3-methyl-1H-pyrazol-5-yl)furan-2-sulfonamide
CID 46329419
N-(3,5-dimethylphenyl)-5-(3-methyl-1H-pyrazol-5-yl)furan-2-sulfonamide
CID 46329421
5-(3,4-Dimethyl-1H-pyrazol-5-YL)-N-(propan-2-YL)furan-2-sulfonamide
CID 50784623
N-cyclopropyl-5-(3,4-dimethyl-1H-pyrazol-5-yl)furan-2-sulfonamide
CID 50784635
N-(Butan-2-YL)-5-(3,4-dimethyl-1H-pyrazol-5-YL)furan-2-sulfonamide
CID 50784780
N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide
CID 23215879

Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (CID 9362162) is N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)NCc1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is JWIGCWBJLIPZPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O3S/c1-10-16(11(2)20-19-10)24(21,22)18-9-14-7-8-15(23-14)12-3-5-13(17)6-4-12/h3-8,18H,9H2,1-2H3,(H,19,20).
What are the key properties of N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 365.84 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 9362162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).