1,5-dimethylpyrazole-4-sulfonamide

C5H9N3O2S — CID 13342781

IUPAC1,5-dimethylpyrazole-4-sulfonamide
SMILESCc1c(S(N)(=O)=O)cnn1C
InChIInChI=1S/C5H9N3O2S/c1-4-5(11(6,9)10)3-7-8(4)2/h3H,1-2H3,(H2,6,9,10)
InChIKeyUQWGJSMSRNAREF-UHFFFAOYSA-N
MW175.21 g/mol
LogP-0.62
Rot. Bonds1

About 1,5-dimethylpyrazole-4-sulfonamide

1,5-dimethylpyrazole-4-sulfonamide (PubChem CID 13342781) has the molecular formula C5H9N3O2S and a molecular weight of 175.21 g/mol. Its IUPAC name is 1,5-dimethylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name1,5-dimethylpyrazole-4-sulfonamide
PubChem CID13342781
Molecular FormulaC5H9N3O2S
Molecular Weight175.21 g/mol
Exact Mass175.04
IUPAC Name1,5-dimethylpyrazole-4-sulfonamide
SMILESCc1c(S(N)(=O)=O)cnn1C
InChIInChI=1S/C5H9N3O2S/c1-4-5(11(6,9)10)3-7-8(4)2/h3H,1-2H3,(H2,6,9,10)
InChIKeyUQWGJSMSRNAREF-UHFFFAOYSA-N
XLogP-0.62
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,3-Dimethylpyrazol-4-yl)sulfonyl-2-methylpiperidine
CID 6465895
1,3-Dimethyl-4-[(4-propylpiperazinyl)sulfonyl]pyrazole
CID 6466875
1,3-dimethyl-1H-pyrazole-4-sulfonyl chloride
CID 4635707
1,3-dimethyl-1H-pyrazole-4-sulfonamide
CID 13342783
3-Methyl-1-(propan-2-yl)-1H-pyrazole-4-sulfonyl chloride
CID 19620090
N-cyclopentyl-1,3-dimethyl-1H-pyrazole-4-sulfonamide
CID 6468008
1-ethyl-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 22203950
1-((1,5-Dimethyl-1H-pyrazol-4-yl)sulfonyl)-4-piperidinamine
CID 25247406
1-Methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonyl chloride
CID 2794561
1-Ethyl-5-methyl-1H-pyrazole-4-sulfonyl chloride
CID 6485338
1-(difluoromethyl)-3-methyl-1H-pyrazole-4-sulfonyl chloride
CID 6485422
1-Ethyl-3-methyl-1H-pyrazole-4-sulfonyl chloride
CID 17024580

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethylpyrazole-4-sulfonamide?
The IUPAC name of 1,5-dimethylpyrazole-4-sulfonamide (CID 13342781) is 1,5-dimethylpyrazole-4-sulfonamide.
What is the SMILES notation for 1,5-dimethylpyrazole-4-sulfonamide?
The canonical SMILES for 1,5-dimethylpyrazole-4-sulfonamide is Cc1c(S(N)(=O)=O)cnn1C.
What is the InChIKey of 1,5-dimethylpyrazole-4-sulfonamide?
The InChIKey is UQWGJSMSRNAREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2S/c1-4-5(11(6,9)10)3-7-8(4)2/h3H,1-2H3,(H2,6,9,10).
What are the key properties of 1,5-dimethylpyrazole-4-sulfonamide?
1,5-dimethylpyrazole-4-sulfonamide has a molecular weight of 175.21 g/mol, XLogP of -0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethylpyrazole-4-sulfonamide is sourced from PubChem (CID 13342781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).