N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide

C15H21N3O2S2 — CID 53131047

IUPACN-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide
SMILESCCCn1nccc1-c1csc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C15H21N3O2S2/c1-2-9-18-14(7-8-16-18)12-10-15(21-11-12)22(19,20)17-13-5-3-4-6-13/h7-8,10-11,13,17H,2-6,9H2,1H3
InChIKeyIIPKMRXHCCJIGE-UHFFFAOYSA-N
MW339.49 g/mol
LogP3.24
Rot. Bonds6

About N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide

N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide (PubChem CID 53131047) has the molecular formula C15H21N3O2S2 and a molecular weight of 339.49 g/mol. Its IUPAC name is N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide
PubChem CID53131047
Molecular FormulaC15H21N3O2S2
Molecular Weight339.49 g/mol
Exact Mass339.11
IUPAC NameN-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide
SMILESCCCn1nccc1-c1csc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C15H21N3O2S2/c1-2-9-18-14(7-8-16-18)12-10-15(21-11-12)22(19,20)17-13-5-3-4-6-13/h7-8,10-11,13,17H,2-6,9H2,1H3
InChIKeyIIPKMRXHCCJIGE-UHFFFAOYSA-N
XLogP3.24
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.49
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide (CID 53131047) is N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide is CCCn1nccc1-c1csc(S(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide?
The InChIKey is IIPKMRXHCCJIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2S2/c1-2-9-18-14(7-8-16-18)12-10-15(21-11-12)22(19,20)17-13-5-3-4-6-13/h7-8,10-11,13,17H,2-6,9H2,1H3.
What are the key properties of N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide?
N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide has a molecular weight of 339.49 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(2-propylpyrazol-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 53131047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).