2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine

C18H29N — CID 65300447

IUPAC2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine
SMILESCc1cc(C)c(CCC2(CCN)CCCC2)c(C)c1
InChIInChI=1S/C18H29N/c1-14-12-15(2)17(16(3)13-14)6-9-18(10-11-19)7-4-5-8-18/h12-13H,4-11,19H2,1-3H3
InChIKeyGLEUFIOZXBCLDC-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.45
Rot. Bonds5

About 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine

2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine (PubChem CID 65300447) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine.

Molecular Properties

Compound Name2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine
PubChem CID65300447
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine
SMILESCc1cc(C)c(CCC2(CCN)CCCC2)c(C)c1
InChIInChI=1S/C18H29N/c1-14-12-15(2)17(16(3)13-14)6-9-18(10-11-19)7-4-5-8-18/h12-13H,4-11,19H2,1-3H3
InChIKeyGLEUFIOZXBCLDC-UHFFFAOYSA-N
XLogP4.45
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine 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-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine?
The IUPAC name of 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine (CID 65300447) is 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine.
What is the SMILES notation for 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine?
The canonical SMILES for 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine is Cc1cc(C)c(CCC2(CCN)CCCC2)c(C)c1.
What is the InChIKey of 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine?
The InChIKey is GLEUFIOZXBCLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-14-12-15(2)17(16(3)13-14)6-9-18(10-11-19)7-4-5-8-18/h12-13H,4-11,19H2,1-3H3.
What are the key properties of 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine?
2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine has a molecular weight of 259.44 g/mol, XLogP of 4.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine is sourced from PubChem (CID 65300447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).