4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide

C18H22N2O3S — CID 110724466

IUPAC4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccc(OC2CCCC2)cc1)c1ccccn1
InChIInChI=1S/C18H22N2O3S/c1-14(18-8-4-5-13-19-18)20-24(21,22)17-11-9-16(10-12-17)23-15-6-2-3-7-15/h4-5,8-15,20H,2-3,6-7H2,1H3
InChIKeyUGVRKMOLOLYJBR-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.44
Rot. Bonds6

About 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide

4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide (PubChem CID 110724466) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide
PubChem CID110724466
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccc(OC2CCCC2)cc1)c1ccccn1
InChIInChI=1S/C18H22N2O3S/c1-14(18-8-4-5-13-19-18)20-24(21,22)17-11-9-16(10-12-17)23-15-6-2-3-7-15/h4-5,8-15,20H,2-3,6-7H2,1H3
InChIKeyUGVRKMOLOLYJBR-UHFFFAOYSA-N
XLogP3.44
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[(1R)-1-pyridin-2-ylethyl]benzenesulfonamide
CID 40664770
4-cyclopentyloxy-N-(2-pyridin-2-ylpropan-2-yl)benzenesulfonamide
CID 113091949
N-[(1S)-1-pyridin-2-ylethyl]naphthalene-2-sulfonamide
CID 2459314
4-[[(1R)-1-pyridin-2-ylethyl]sulfamoyl]benzamide
CID 92520286
ethyl 4-(1-pyridin-2-ylethylsulfamoyl)benzoate
CID 4878822
3,5-difluoro-N-[(1S)-1-pyridin-2-ylethyl]benzenesulfonamide
CID 41084343
2,4-dimethoxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 110724455
N-[(1R)-1-pyridin-2-ylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 26943769
3-fluoro-4-methyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 46452389
6-(aminomethyl)-N-(1-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 114613153
6-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 43524541
3-fluoro-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 18086450

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The IUPAC name of 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide (CID 110724466) is 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The canonical SMILES for 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide is CC(NS(=O)(=O)c1ccc(OC2CCCC2)cc1)c1ccccn1.
What is the InChIKey of 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The InChIKey is UGVRKMOLOLYJBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-14(18-8-4-5-13-19-18)20-24(21,22)17-11-9-16(10-12-17)23-15-6-2-3-7-15/h4-5,8-15,20H,2-3,6-7H2,1H3.
What are the key properties of 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide has a molecular weight of 346.45 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide is sourced from PubChem (CID 110724466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).