N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide

C18H20ClNO3S — CID 113098120

IUPACN-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide
SMILESO=S(=O)(NCc1ccc(Cl)cc1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C18H20ClNO3S/c19-15-7-5-14(6-8-15)13-20-24(21,22)18-11-9-17(10-12-18)23-16-3-1-2-4-16/h5-12,16,20H,1-4,13H2
InChIKeyZACBOAAXOACJLM-UHFFFAOYSA-N
MW365.88 g/mol
LogP4.14
Rot. Bonds6

About N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide

N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide (PubChem CID 113098120) has the molecular formula C18H20ClNO3S and a molecular weight of 365.88 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide
PubChem CID113098120
Molecular FormulaC18H20ClNO3S
Molecular Weight365.88 g/mol
Exact Mass365.09
IUPAC NameN-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide
SMILESO=S(=O)(NCc1ccc(Cl)cc1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C18H20ClNO3S/c19-15-7-5-14(6-8-15)13-20-24(21,22)18-11-9-17(10-12-18)23-16-3-1-2-4-16/h5-12,16,20H,1-4,13H2
InChIKeyZACBOAAXOACJLM-UHFFFAOYSA-N
XLogP4.14
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.88
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide 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

1-cyclopentyloxy-4-[(dimethylsulfamoylamino)methyl]benzene
CID 110781232
N-[[4-(aminomethyl)phenyl]methyl]-4-chlorobenzenesulfonamide
CID 81089757
N-[(4-chlorophenyl)methyl]-4-iodobenzenesulfonamide
CID 5000374
4-chloro-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide
CID 18096857
4-chloro-N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]benzenesulfonamide
CID 31113443
4-cyclopentyloxy-N-[3-(dimethylamino)propyl]benzenesulfonamide
CID 110408180
4-cyclopentyloxy-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzenesulfonamide
CID 110642380
N-[(4-cyclopentyloxyphenyl)methyl]cyclopropanamine
CID 39248013
N-[(4-cyclopentyloxyphenyl)methyl]cyclopentanamine
CID 39360486
4-cyclopentyloxy-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605334
3-[(4-chlorophenyl)methyl]-N-(4-cyclopentyloxyphenyl)-2-oxo-1,3-benzothiazole-6-sulfonamide
CID 100752945
N-[(4-cyclopentyloxyphenyl)methyl]cyclohexanamine
CID 39372881

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide (CID 113098120) is N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide is O=S(=O)(NCc1ccc(Cl)cc1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide?
The InChIKey is ZACBOAAXOACJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO3S/c19-15-7-5-14(6-8-15)13-20-24(21,22)18-11-9-17(10-12-18)23-16-3-1-2-4-16/h5-12,16,20H,1-4,13H2.
What are the key properties of N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide?
N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide has a molecular weight of 365.88 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide is sourced from PubChem (CID 113098120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).