N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide

C18H30N2O3S — CID 110302652

IUPACN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide
SMILESCCN(CC)C(CNS(=O)(=O)C1CCCC1)c1ccc(OC)cc1
InChIInChI=1S/C18H30N2O3S/c1-4-20(5-2)18(15-10-12-16(23-3)13-11-15)14-19-24(21,22)17-8-6-7-9-17/h10-13,17-19H,4-9,14H2,1-3H3
InChIKeyFWGUAMZSRWQIQH-UHFFFAOYSA-N
MW354.52 g/mol
LogP2.94
Rot. Bonds9

About N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide

N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide (PubChem CID 110302652) has the molecular formula C18H30N2O3S and a molecular weight of 354.52 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide
PubChem CID110302652
Molecular FormulaC18H30N2O3S
Molecular Weight354.52 g/mol
Exact Mass354.20
IUPAC NameN-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide
SMILESCCN(CC)C(CNS(=O)(=O)C1CCCC1)c1ccc(OC)cc1
InChIInChI=1S/C18H30N2O3S/c1-4-20(5-2)18(15-10-12-16(23-3)13-11-15)14-19-24(21,22)17-8-6-7-9-17/h10-13,17-19H,4-9,14H2,1-3H3
InChIKeyFWGUAMZSRWQIQH-UHFFFAOYSA-N
XLogP2.94
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.52
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide
CID 110302059
N-[2-(diethylamino)-2-thiophen-2-ylethyl]cyclopentanesulfonamide
CID 110302742
N-[(2S)-2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 166440574
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-1-phenylmethanesulfonamide
CID 112503701
N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide
CID 110301928
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3-methylsulfonylpropanamide
CID 110621812
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]cyclohexanesulfonamide
CID 90623438
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-3,5-dimethoxybenzamide
CID 112503668
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]cyclohexanecarboxamide
CID 17447079
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]morpholine-4-carboxamide
CID 112503691
2-cyclohexylsulfonyl-1-(4-methoxyphenyl)ethanamine
CID 64675196
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-N-methylcyclopentanesulfonamide
CID 110308806

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide?
The IUPAC name of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide (CID 110302652) is N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide.
What is the SMILES notation for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide?
The canonical SMILES for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide is CCN(CC)C(CNS(=O)(=O)C1CCCC1)c1ccc(OC)cc1.
What is the InChIKey of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide?
The InChIKey is FWGUAMZSRWQIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O3S/c1-4-20(5-2)18(15-10-12-16(23-3)13-11-15)14-19-24(21,22)17-8-6-7-9-17/h10-13,17-19H,4-9,14H2,1-3H3.
What are the key properties of N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide?
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide has a molecular weight of 354.52 g/mol, XLogP of 2.94, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]cyclopentanesulfonamide is sourced from PubChem (CID 110302652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).