N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide

C10H11ClN4O2S — CID 57244208

IUPACN-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1[nH]ncc1Nc1cccc(Cl)c1
InChIInChI=1S/C10H11ClN4O2S/c1-18(16,17)15-10-9(6-12-14-10)13-8-4-2-3-7(11)5-8/h2-6,13H,1H3,(H2,12,14,15)
InChIKeyOFLHAPYBPWMEGC-UHFFFAOYSA-N
MW286.74 g/mol
LogP2.18
Rot. Bonds4

About N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide

N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide (PubChem CID 57244208) has the molecular formula C10H11ClN4O2S and a molecular weight of 286.74 g/mol. Its IUPAC name is N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide
PubChem CID57244208
Molecular FormulaC10H11ClN4O2S
Molecular Weight286.74 g/mol
Exact Mass286.03
IUPAC NameN-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1[nH]ncc1Nc1cccc(Cl)c1
InChIInChI=1S/C10H11ClN4O2S/c1-18(16,17)15-10-9(6-12-14-10)13-8-4-2-3-7(11)5-8/h2-6,13H,1H3,(H2,12,14,15)
InChIKeyOFLHAPYBPWMEGC-UHFFFAOYSA-N
XLogP2.18
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.74
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide 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

4-N-(3-chlorophenyl)-5-N-(4-iodophenyl)-1H-pyrazole-4,5-diamine
CID 57295767
4-N-(3-chlorophenyl)-1H-pyrazole-4,5-diamine
CID 57126804
N-[4-[4-(3-chloroanilino)-1H-pyrazol-5-yl]phenyl]-4-methylbenzenesulfonamide
CID 67645185
2-[[4-(3-chloroanilino)-1H-pyrazol-5-yl]amino]ethylurea
CID 57098049
N-[4-[[[4-(3-chloroanilino)-1H-pyrazol-5-yl]amino]methyl]phenyl]formamide
CID 57071330
N-[2-[[4-(3-chloroanilino)-1H-pyrazol-5-yl]amino]ethyl]benzamide
CID 57263599
4-[[[4-(3-chloroanilino)-1H-pyrazol-5-yl]amino]methyl]-2,6-dimethoxyphenol
CID 57166762
N-[3-[4-(3-chloroanilino)-1H-pyrazol-5-yl]phenyl]propanamide
CID 57298787
ethyl N-[(2S)-1-[[4-(3-chloroanilino)-1H-pyrazol-5-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 56987114
N-(3-chlorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691568
N-(3-bromophenyl)-5-methyl-1H-pyrazol-4-amine
CID 115046902
N-[[4-[[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]methyl]methanesulfonamide
CID 19610552

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide?
The IUPAC name of N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide (CID 57244208) is N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide.
What is the SMILES notation for N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide?
The canonical SMILES for N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide is CS(=O)(=O)Nc1[nH]ncc1Nc1cccc(Cl)c1.
What is the InChIKey of N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide?
The InChIKey is OFLHAPYBPWMEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O2S/c1-18(16,17)15-10-9(6-12-14-10)13-8-4-2-3-7(11)5-8/h2-6,13H,1H3,(H2,12,14,15).
What are the key properties of N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide?
N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide has a molecular weight of 286.74 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-chloroanilino)-1H-pyrazol-5-yl]methanesulfonamide is sourced from PubChem (CID 57244208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).