N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline

C19H24N2 — CID 64680569

IUPACN-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline
SMILESNC1(CCNc2ccc(-c3ccccc3)cc2)CCCC1
InChIInChI=1S/C19H24N2/c20-19(12-4-5-13-19)14-15-21-18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,21H,4-5,12-15,20H2
InChIKeyUMURBOFLZDIXGI-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.43
Rot. Bonds5

About N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline

N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline (PubChem CID 64680569) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline.

Molecular Properties

Compound NameN-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline
PubChem CID64680569
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline
SMILESNC1(CCNc2ccc(-c3ccccc3)cc2)CCCC1
InChIInChI=1S/C19H24N2/c20-19(12-4-5-13-19)14-15-21-18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,21H,4-5,12-15,20H2
InChIKeyUMURBOFLZDIXGI-UHFFFAOYSA-N
XLogP4.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline 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-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline?
The IUPAC name of N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline (CID 64680569) is N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline.
What is the SMILES notation for N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline?
The canonical SMILES for N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline is NC1(CCNc2ccc(-c3ccccc3)cc2)CCCC1.
What is the InChIKey of N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline?
The InChIKey is UMURBOFLZDIXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c20-19(12-4-5-13-19)14-15-21-18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,21H,4-5,12-15,20H2.
What are the key properties of N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline?
N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline has a molecular weight of 280.42 g/mol, XLogP of 4.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminocyclopentyl)ethyl]-4-phenylaniline is sourced from PubChem (CID 64680569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).