2-[4-(1-cyclopentylethyl)phenyl]ethanamine

C15H23N — CID 115030340

IUPAC2-[4-(1-cyclopentylethyl)phenyl]ethanamine
SMILESCC(c1ccc(CCN)cc1)C1CCCC1
InChIInChI=1S/C15H23N/c1-12(14-4-2-3-5-14)15-8-6-13(7-9-15)10-11-16/h6-9,12,14H,2-5,10-11,16H2,1H3
InChIKeyQDYDMVKRUBGJOZ-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.48
Rot. Bonds4

About 2-[4-(1-cyclopentylethyl)phenyl]ethanamine

2-[4-(1-cyclopentylethyl)phenyl]ethanamine (PubChem CID 115030340) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-[4-(1-cyclopentylethyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-(1-cyclopentylethyl)phenyl]ethanamine
PubChem CID115030340
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-[4-(1-cyclopentylethyl)phenyl]ethanamine
SMILESCC(c1ccc(CCN)cc1)C1CCCC1
InChIInChI=1S/C15H23N/c1-12(14-4-2-3-5-14)15-8-6-13(7-9-15)10-11-16/h6-9,12,14H,2-5,10-11,16H2,1H3
InChIKeyQDYDMVKRUBGJOZ-UHFFFAOYSA-N
XLogP3.48
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-cyclopentylethyl)phenyl]ethanamine?
The IUPAC name of 2-[4-(1-cyclopentylethyl)phenyl]ethanamine (CID 115030340) is 2-[4-(1-cyclopentylethyl)phenyl]ethanamine.
What is the SMILES notation for 2-[4-(1-cyclopentylethyl)phenyl]ethanamine?
The canonical SMILES for 2-[4-(1-cyclopentylethyl)phenyl]ethanamine is CC(c1ccc(CCN)cc1)C1CCCC1.
What is the InChIKey of 2-[4-(1-cyclopentylethyl)phenyl]ethanamine?
The InChIKey is QDYDMVKRUBGJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12(14-4-2-3-5-14)15-8-6-13(7-9-15)10-11-16/h6-9,12,14H,2-5,10-11,16H2,1H3.
What are the key properties of 2-[4-(1-cyclopentylethyl)phenyl]ethanamine?
2-[4-(1-cyclopentylethyl)phenyl]ethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-cyclopentylethyl)phenyl]ethanamine is sourced from PubChem (CID 115030340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).