2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide

C10H18N4O2S — CID 104709488

IUPAC2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide
SMILESCC(NS(=O)(=O)c1ccnn1C)C1CCNC1
InChIInChI=1S/C10H18N4O2S/c1-8(9-3-5-11-7-9)13-17(15,16)10-4-6-12-14(10)2/h4,6,8-9,11,13H,3,5,7H2,1-2H3
InChIKeyYZRXYOFUJYTQPY-UHFFFAOYSA-N
MW258.35 g/mol
LogP-0.30
Rot. Bonds4

About 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide

2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide (PubChem CID 104709488) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide
PubChem CID104709488
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide
SMILESCC(NS(=O)(=O)c1ccnn1C)C1CCNC1
InChIInChI=1S/C10H18N4O2S/c1-8(9-3-5-11-7-9)13-17(15,16)10-4-6-12-14(10)2/h4,6,8-9,11,13H,3,5,7H2,1-2H3
InChIKeyYZRXYOFUJYTQPY-UHFFFAOYSA-N
XLogP-0.30
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
CID 104709475
N-[(1R)-1-[(3R)-1-benzylpyrrolidin-3-yl]ethyl]-2-methylpyrazole-3-sulfonamide
CID 124739763
N-[(1S)-1-[(3R)-1-benzylpyrrolidin-3-yl]ethyl]-2-methylpyrazole-3-sulfonamide
CID 124739764
2,4,6-trifluoro-N-(1-pyrrolidin-3-ylethyl)benzenesulfonamide
CID 103976987
4-fluoro-2,6-dimethyl-N-(1-pyrrolidin-3-ylethyl)benzenesulfonamide
CID 107326180
2-cyclopropyl-2-[(2-methylpyrazol-3-yl)sulfonylamino]ethanimidamide
CID 104710773
N,2-dimethyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide;hydrochloride
CID 120709852
N-(1-hydroxypropan-2-yl)-2-methylpyrazole-3-sulfonamide
CID 104710044
N-[(2S)-1-aminopropan-2-yl]-2-methylpyrazole-3-sulfonamide;hydrochloride
CID 120713110
N-cyclopentyl-2-methylpyrazole-3-sulfonamide
CID 104709770
N-(1-piperidin-3-ylethyl)furan-2-sulfonamide
CID 120874778
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrazole-3-sulfonamide
CID 106630912

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide?
The IUPAC name of 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide (CID 104709488) is 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide?
The canonical SMILES for 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide is CC(NS(=O)(=O)c1ccnn1C)C1CCNC1.
What is the InChIKey of 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide?
The InChIKey is YZRXYOFUJYTQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-8(9-3-5-11-7-9)13-17(15,16)10-4-6-12-14(10)2/h4,6,8-9,11,13H,3,5,7H2,1-2H3.
What are the key properties of 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide?
2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide is sourced from PubChem (CID 104709488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).