3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine

C13H18ClN — CID 64908329

IUPAC3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine
SMILESCNC1CCC(c2ccccc2Cl)C1C
InChIInChI=1S/C13H18ClN/c1-9-10(7-8-13(9)15-2)11-5-3-4-6-12(11)14/h3-6,9-10,13,15H,7-8H2,1-2H3
InChIKeyNKFAGLSRTWOUNH-UHFFFAOYSA-N
MW223.75 g/mol
LogP3.44
Rot. Bonds2

About 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine

3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine (PubChem CID 64908329) has the molecular formula C13H18ClN and a molecular weight of 223.75 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine
PubChem CID64908329
Molecular FormulaC13H18ClN
Molecular Weight223.75 g/mol
Exact Mass223.11
IUPAC Name3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine
SMILESCNC1CCC(c2ccccc2Cl)C1C
InChIInChI=1S/C13H18ClN/c1-9-10(7-8-13(9)15-2)11-5-3-4-6-12(11)14/h3-6,9-10,13,15H,7-8H2,1-2H3
InChIKeyNKFAGLSRTWOUNH-UHFFFAOYSA-N
XLogP3.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.75
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine?
The IUPAC name of 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine (CID 64908329) is 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine is CNC1CCC(c2ccccc2Cl)C1C.
What is the InChIKey of 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine?
The InChIKey is NKFAGLSRTWOUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN/c1-9-10(7-8-13(9)15-2)11-5-3-4-6-12(11)14/h3-6,9-10,13,15H,7-8H2,1-2H3.
What are the key properties of 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine?
3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine has a molecular weight of 223.75 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-N,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 64908329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).