1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine

C9H16N4O2S — CID 61225373

IUPAC1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine
SMILESCC1CCN(S(=O)(=O)c2cn(C)nc2N)C1
InChIInChI=1S/C9H16N4O2S/c1-7-3-4-13(5-7)16(14,15)8-6-12(2)11-9(8)10/h6-7H,3-5H2,1-2H3,(H2,10,11)
InChIKeySFTGPGBEOZYJIP-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.03
Rot. Bonds2

About 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine

1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine (PubChem CID 61225373) has the molecular formula C9H16N4O2S and a molecular weight of 244.32 g/mol. Its IUPAC name is 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine
PubChem CID61225373
Molecular FormulaC9H16N4O2S
Molecular Weight244.32 g/mol
Exact Mass244.10
IUPAC Name1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine
SMILESCC1CCN(S(=O)(=O)c2cn(C)nc2N)C1
InChIInChI=1S/C9H16N4O2S/c1-7-3-4-13(5-7)16(14,15)8-6-12(2)11-9(8)10/h6-7H,3-5H2,1-2H3,(H2,10,11)
InChIKeySFTGPGBEOZYJIP-UHFFFAOYSA-N
XLogP0.03
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-ethylpyrazol-4-yl)sulfonyl-3-(2H-tetrazol-5-yl)piperidine
CID 91909493
N-(1,4-dimethylpyrrolidin-3-yl)-1-ethylpyrazole-4-sulfonamide
CID 71927258
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-1-ethylpyrazole-4-sulfonamide
CID 71997776
3-amino-N-cyclopropyl-1-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 55006605
3-amino-N-ethyl-1-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 55006939
3-amino-N,1-diethyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 55006940
3-amino-1-methyl-N-(3,3,3-trifluoropropyl)pyrazole-4-sulfonamide
CID 55174165
3-amino-1-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60809738
3-amino-1-ethyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60809899
3-amino-1-propyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60809900
3-amino-N,1-dimethyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60892700
3-amino-1-ethyl-N-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60892701

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine?
The IUPAC name of 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine (CID 61225373) is 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine.
What is the SMILES notation for 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine?
The canonical SMILES for 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine is CC1CCN(S(=O)(=O)c2cn(C)nc2N)C1.
What is the InChIKey of 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine?
The InChIKey is SFTGPGBEOZYJIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2S/c1-7-3-4-13(5-7)16(14,15)8-6-12(2)11-9(8)10/h6-7H,3-5H2,1-2H3,(H2,10,11).
What are the key properties of 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine?
1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine has a molecular weight of 244.32 g/mol, XLogP of 0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(3-methylpyrrolidin-1-yl)sulfonylpyrazol-3-amine is sourced from PubChem (CID 61225373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).