1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide

C16H23N5O2S — CID 146141100

IUPAC1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide
SMILESCc1c(NS(=O)(=O)c2cnn(C3CCC3)c2)cnn1C1CCCC1
InChIInChI=1S/C16H23N5O2S/c1-12-16(10-18-21(12)14-5-2-3-6-14)19-24(22,23)15-9-17-20(11-15)13-7-4-8-13/h9-11,13-14,19H,2-8H2,1H3
InChIKeyFIPVEDOGGLPNSZ-UHFFFAOYSA-N
MW349.46 g/mol
LogP3.03
Rot. Bonds5

About 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide

1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide (PubChem CID 146141100) has the molecular formula C16H23N5O2S and a molecular weight of 349.46 g/mol. Its IUPAC name is 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide
PubChem CID146141100
Molecular FormulaC16H23N5O2S
Molecular Weight349.46 g/mol
Exact Mass349.16
IUPAC Name1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide
SMILESCc1c(NS(=O)(=O)c2cnn(C3CCC3)c2)cnn1C1CCCC1
InChIInChI=1S/C16H23N5O2S/c1-12-16(10-18-21(12)14-5-2-3-6-14)19-24(22,23)15-9-17-20(11-15)13-7-4-8-13/h9-11,13-14,19H,2-8H2,1H3
InChIKeyFIPVEDOGGLPNSZ-UHFFFAOYSA-N
XLogP3.03
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide?
The IUPAC name of 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide (CID 146141100) is 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide.
What is the SMILES notation for 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide?
The canonical SMILES for 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide is Cc1c(NS(=O)(=O)c2cnn(C3CCC3)c2)cnn1C1CCCC1.
What is the InChIKey of 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide?
The InChIKey is FIPVEDOGGLPNSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2S/c1-12-16(10-18-21(12)14-5-2-3-6-14)19-24(22,23)15-9-17-20(11-15)13-7-4-8-13/h9-11,13-14,19H,2-8H2,1H3.
What are the key properties of 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide?
1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide has a molecular weight of 349.46 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(1-cyclopentyl-5-methylpyrazol-4-yl)pyrazole-4-sulfonamide is sourced from PubChem (CID 146141100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).