N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide

C15H24N2O2S — CID 110301928

IUPACN-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide
SMILESCN(C)C(CNS(=O)(=O)C1CCCC1)c1ccccc1
InChIInChI=1S/C15H24N2O2S/c1-17(2)15(13-8-4-3-5-9-13)12-16-20(18,19)14-10-6-7-11-14/h3-5,8-9,14-16H,6-7,10-12H2,1-2H3
InChIKeyAWHIHJGSHGAARP-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.15
Rot. Bonds6

About N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide

N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide (PubChem CID 110301928) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide
PubChem CID110301928
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide
SMILESCN(C)C(CNS(=O)(=O)C1CCCC1)c1ccccc1
InChIInChI=1S/C15H24N2O2S/c1-17(2)15(13-8-4-3-5-9-13)12-16-20(18,19)14-10-6-7-11-14/h3-5,8-9,14-16H,6-7,10-12H2,1-2H3
InChIKeyAWHIHJGSHGAARP-UHFFFAOYSA-N
XLogP2.15
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide?
The IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide (CID 110301928) is N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide?
The canonical SMILES for N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide is CN(C)C(CNS(=O)(=O)C1CCCC1)c1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide?
The InChIKey is AWHIHJGSHGAARP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-17(2)15(13-8-4-3-5-9-13)12-16-20(18,19)14-10-6-7-11-14/h3-5,8-9,14-16H,6-7,10-12H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide?
N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide is sourced from PubChem (CID 110301928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).