N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide

C10H12N4O2S — CID 102693540

IUPACN-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide
SMILESCNc1ccc(NS(=O)(=O)c2ccn[nH]2)cc1
InChIInChI=1S/C10H12N4O2S/c1-11-8-2-4-9(5-3-8)14-17(15,16)10-6-7-12-13-10/h2-7,11,14H,1H3,(H,12,13)
InChIKeySGRSGRKNYXMJCT-UHFFFAOYSA-N
MW252.30 g/mol
LogP1.25
Rot. Bonds4

About N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide

N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide (PubChem CID 102693540) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide
PubChem CID102693540
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC NameN-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide
SMILESCNc1ccc(NS(=O)(=O)c2ccn[nH]2)cc1
InChIInChI=1S/C10H12N4O2S/c1-11-8-2-4-9(5-3-8)14-17(15,16)10-6-7-12-13-10/h2-7,11,14H,1H3,(H,12,13)
InChIKeySGRSGRKNYXMJCT-UHFFFAOYSA-N
XLogP1.25
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-tert-butylphenyl)-1H-pyrazole-5-sulfonamide
CID 102691460
N-(4-ethylsulfonylphenyl)-1H-pyrazole-5-sulfonamide
CID 102692588
N-(6-methylsulfonyl-3-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 102692515
N-[4-(2-methoxyethoxy)phenyl]-1H-pyrazole-5-sulfonamide
CID 102692703
N-(3,5-difluorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691589
3-[4-(1H-pyrazol-5-ylsulfonylamino)phenyl]butanoic acid
CID 102690958
2-methyl-4-(1H-pyrazol-5-ylsulfonylamino)benzenesulfonyl chloride
CID 102691035
4-(1H-pyrazol-5-ylsulfonylamino)benzenecarboximidamide
CID 102694175
N-[3-(sulfamoylamino)phenyl]-1H-pyrazole-5-sulfonamide
CID 102692751
2-chloro-4-(1H-pyrazol-5-ylsulfonylamino)benzenesulfonyl chloride
CID 102691039
N-(3-chlorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691568
N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide
CID 102990020

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide (CID 102693540) is N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide is CNc1ccc(NS(=O)(=O)c2ccn[nH]2)cc1.
What is the InChIKey of N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide?
The InChIKey is SGRSGRKNYXMJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-11-8-2-4-9(5-3-8)14-17(15,16)10-6-7-12-13-10/h2-7,11,14H,1H3,(H,12,13).
What are the key properties of N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide?
N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide has a molecular weight of 252.30 g/mol, XLogP of 1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102693540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).