N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine

C16H19NO2S — CID 64647317

IUPACN-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine
SMILESCNC1CCCC1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19NO2S/c1-17-15-7-4-8-16(15)20(18,19)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,15-17H,4,7-8H2,1H3
InChIKeyOMDVGGUAJVXRFH-UHFFFAOYSA-N
MW289.40 g/mol
LogP2.75
Rot. Bonds3

About N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine

N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine (PubChem CID 64647317) has the molecular formula C16H19NO2S and a molecular weight of 289.40 g/mol. Its IUPAC name is N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine
PubChem CID64647317
Molecular FormulaC16H19NO2S
Molecular Weight289.40 g/mol
Exact Mass289.11
IUPAC NameN-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine
SMILESCNC1CCCC1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19NO2S/c1-17-15-7-4-8-16(15)20(18,19)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,15-17H,4,7-8H2,1H3
InChIKeyOMDVGGUAJVXRFH-UHFFFAOYSA-N
XLogP2.75
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine?
The IUPAC name of N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine (CID 64647317) is N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine.
What is the SMILES notation for N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine?
The canonical SMILES for N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine is CNC1CCCC1S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine?
The InChIKey is OMDVGGUAJVXRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2S/c1-17-15-7-4-8-16(15)20(18,19)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,15-17H,4,7-8H2,1H3.
What are the key properties of N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine?
N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine has a molecular weight of 289.40 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-naphthalen-2-ylsulfonylcyclopentan-1-amine is sourced from PubChem (CID 64647317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).