2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine

C16H18N2O — CID 117051665

IUPAC2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine
SMILESNC1CCCC1Oc1ccc(-c2ccccn2)cc1
InChIInChI=1S/C16H18N2O/c17-14-4-3-6-16(14)19-13-9-7-12(8-10-13)15-5-1-2-11-18-15/h1-2,5,7-11,14,16H,3-4,6,17H2
InChIKeyBIIBIESUVYNMMC-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.01
Rot. Bonds3

About 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine

2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine (PubChem CID 117051665) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine
PubChem CID117051665
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine
SMILESNC1CCCC1Oc1ccc(-c2ccccn2)cc1
InChIInChI=1S/C16H18N2O/c17-14-4-3-6-16(14)19-13-9-7-12(8-10-13)15-5-1-2-11-18-15/h1-2,5,7-11,14,16H,3-4,6,17H2
InChIKeyBIIBIESUVYNMMC-UHFFFAOYSA-N
XLogP3.01
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-pyridin-2-ylphenoxy)cyclopentan-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 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine?
The IUPAC name of 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine (CID 117051665) is 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine.
What is the SMILES notation for 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine?
The canonical SMILES for 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine is NC1CCCC1Oc1ccc(-c2ccccn2)cc1.
What is the InChIKey of 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine?
The InChIKey is BIIBIESUVYNMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c17-14-4-3-6-16(14)19-13-9-7-12(8-10-13)15-5-1-2-11-18-15/h1-2,5,7-11,14,16H,3-4,6,17H2.
What are the key properties of 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine?
2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine has a molecular weight of 254.33 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-2-ylphenoxy)cyclopentan-1-amine is sourced from PubChem (CID 117051665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).