2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide

C19H23NO3S — CID 55477227

IUPAC2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C19H23NO3S/c1-23-17-11-5-6-12-18(17)24(21,22)20-15-19(13-7-8-14-19)16-9-3-2-4-10-16/h2-6,9-12,20H,7-8,13-15H2,1H3
InChIKeyKIBHINDIDILYPO-UHFFFAOYSA-N
MW345.46 g/mol
LogP3.49
Rot. Bonds6

About 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide

2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide (PubChem CID 55477227) has the molecular formula C19H23NO3S and a molecular weight of 345.46 g/mol. Its IUPAC name is 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide
PubChem CID55477227
Molecular FormulaC19H23NO3S
Molecular Weight345.46 g/mol
Exact Mass345.14
IUPAC Name2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C19H23NO3S/c1-23-17-11-5-6-12-18(17)24(21,22)20-15-19(13-7-8-14-19)16-9-3-2-4-10-16/h2-6,9-12,20H,7-8,13-15H2,1H3
InChIKeyKIBHINDIDILYPO-UHFFFAOYSA-N
XLogP3.49
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.46
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-hydroxycyclobutyl)methyl]-2-methoxybenzenesulfonamide
CID 115753878
N-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl]benzenesulfonamide
CID 1114580
N-[(1-phenylcyclopentyl)methyl]methanesulfonamide
CID 47016388
3,4-dimethoxy-N-[(1-phenylcyclopropyl)methyl]benzenesulfonamide
CID 42269288
2,4-dimethoxy-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943344
3-chloro-2-methyl-N-[(1-phenylcyclopropyl)methyl]benzenesulfonamide
CID 39628447
2-chloro-N-[[1-(3,4-dimethoxyphenyl)cyclopropyl]methyl]benzenesulfonamide
CID 113090921
N-[(1-phenylcyclobutyl)methyl]ethanesulfonamide
CID 113090928
2,3,4-trifluoro-N-[(1-phenylcyclobutyl)methyl]benzenesulfonamide
CID 51111664
2-methoxy-N-propylbenzenesulfonamide
CID 23128752
2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzenesulfonamide;hydrochloride
CID 120896450
2,4,5-trimethyl-N-[(4-phenyloxan-4-yl)methyl]benzenesulfonamide
CID 27450272

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide?
The IUPAC name of 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide (CID 55477227) is 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide.
What is the SMILES notation for 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide?
The canonical SMILES for 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide is COc1ccccc1S(=O)(=O)NCC1(c2ccccc2)CCCC1.
What is the InChIKey of 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide?
The InChIKey is KIBHINDIDILYPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3S/c1-23-17-11-5-6-12-18(17)24(21,22)20-15-19(13-7-8-14-19)16-9-3-2-4-10-16/h2-6,9-12,20H,7-8,13-15H2,1H3.
What are the key properties of 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide?
2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide has a molecular weight of 345.46 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide is sourced from PubChem (CID 55477227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).