N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide

C13H21N3O2S — CID 71808710

IUPACN-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCc1cc(C2CC2)n(C2CCCC2)n1
InChIInChI=1S/C13H21N3O2S/c1-19(17,18)14-9-11-8-13(10-6-7-10)16(15-11)12-4-2-3-5-12/h8,10,12,14H,2-7,9H2,1H3
InChIKeyZRUHITACMXWFFL-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.92
Rot. Bonds5

About N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide

N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide (PubChem CID 71808710) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide
PubChem CID71808710
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCc1cc(C2CC2)n(C2CCCC2)n1
InChIInChI=1S/C13H21N3O2S/c1-19(17,18)14-9-11-8-13(10-6-7-10)16(15-11)12-4-2-3-5-12/h8,10,12,14H,2-7,9H2,1H3
InChIKeyZRUHITACMXWFFL-UHFFFAOYSA-N
XLogP1.92
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide?
The IUPAC name of N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide (CID 71808710) is N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide?
The canonical SMILES for N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide is CS(=O)(=O)NCc1cc(C2CC2)n(C2CCCC2)n1.
What is the InChIKey of N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide?
The InChIKey is ZRUHITACMXWFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-19(17,18)14-9-11-8-13(10-6-7-10)16(15-11)12-4-2-3-5-12/h8,10,12,14H,2-7,9H2,1H3.
What are the key properties of N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide?
N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-5-cyclopropylpyrazol-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 71808710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).