1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide

C18H22ClNO4S — CID 90536550

IUPAC1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide
SMILESCc1ccc(C(CNS(=O)(=O)Cc2ccc(Cl)cc2)OCCO)cc1
InChIInChI=1S/C18H22ClNO4S/c1-14-2-6-16(7-3-14)18(24-11-10-21)12-20-25(22,23)13-15-4-8-17(19)9-5-15/h2-9,18,20-21H,10-13H2,1H3
InChIKeyRQKYCCWFAGMEND-UHFFFAOYSA-N
MW383.90 g/mol
LogP2.82
Rot. Bonds9

About 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide

1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide (PubChem CID 90536550) has the molecular formula C18H22ClNO4S and a molecular weight of 383.90 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide
PubChem CID90536550
Molecular FormulaC18H22ClNO4S
Molecular Weight383.90 g/mol
Exact Mass383.10
IUPAC Name1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide
SMILESCc1ccc(C(CNS(=O)(=O)Cc2ccc(Cl)cc2)OCCO)cc1
InChIInChI=1S/C18H22ClNO4S/c1-14-2-6-16(7-3-14)18(24-11-10-21)12-20-25(22,23)13-15-4-8-17(19)9-5-15/h2-9,18,20-21H,10-13H2,1H3
InChIKeyRQKYCCWFAGMEND-UHFFFAOYSA-N
XLogP2.82
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.90
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide 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

[(R)-2-(o-chlorophenyl)-2-methoxyethyl]{[p-(trifluoromethyl)phenyl]methylsulfonyl}amine
CID 99876219
N-[5-(4-chlorophenyl)-3,4-dihydroxyoxolan-2-yl]ethanesulfonamide
CID 171346264
N-(2-(2-hydroxyethoxy)-2-(p-tolyl)ethyl)cyclopropanesulfonamide
CID 76146324
[(o-chlorophenyl)methylsulfonyl][(R)-2-methoxy-2-(o-tolyl)ethyl]amine
CID 97417800
N-[2-(4-chlorophenyl)-2-methoxyethyl]-4-methylbenzenesulfonamide
CID 134843251
N-[2-(4-chlorophenyl)-2-ethoxyethyl]-4-methylbenzenesulfonamide
CID 134844608
1-(3-chlorophenyl)-N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide
CID 73168441
2,6-difluoro-N-(2-(2-hydroxyethoxy)-2-(p-tolyl)ethyl)benzenesulfonamide
CID 76146328
3-chloro-4-fluoro-N-(2-(2-hydroxyethoxy)-2-(p-tolyl)ethyl)benzenesulfonamide
CID 76146332
N-[2-(2-chlorophenyl)-2-methoxyethyl]-1-(3,5-difluorophenyl)methanesulfonamide
CID 76149866
N-[2-(2-chlorophenyl)-2-methoxyethyl]-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 76149867
1-(4-chlorophenyl)-N-(2-hydroxy-2-(4-(trifluoromethyl)phenyl)ethyl)methanesulfonamide
CID 90534840

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide?
The IUPAC name of 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide (CID 90536550) is 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide is Cc1ccc(C(CNS(=O)(=O)Cc2ccc(Cl)cc2)OCCO)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide?
The InChIKey is RQKYCCWFAGMEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22ClNO4S/c1-14-2-6-16(7-3-14)18(24-11-10-21)12-20-25(22,23)13-15-4-8-17(19)9-5-15/h2-9,18,20-21H,10-13H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide?
1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide has a molecular weight of 383.90 g/mol, XLogP of 2.82, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-[2-(2-hydroxyethoxy)-2-(4-methylphenyl)ethyl]methanesulfonamide is sourced from PubChem (CID 90536550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).