2-[3-(4-methylphenyl)cyclopentyl]ethanamine

C14H21N — CID 82282657

IUPAC2-[3-(4-methylphenyl)cyclopentyl]ethanamine
SMILESCc1ccc(C2CCC(CCN)C2)cc1
InChIInChI=1S/C14H21N/c1-11-2-5-13(6-3-11)14-7-4-12(10-14)8-9-15/h2-3,5-6,12,14H,4,7-10,15H2,1H3
InChIKeyRPJLWSVSSOXWPX-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.23
Rot. Bonds3

About 2-[3-(4-methylphenyl)cyclopentyl]ethanamine

2-[3-(4-methylphenyl)cyclopentyl]ethanamine (PubChem CID 82282657) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-[3-(4-methylphenyl)cyclopentyl]ethanamine.

Molecular Properties

Compound Name2-[3-(4-methylphenyl)cyclopentyl]ethanamine
PubChem CID82282657
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-[3-(4-methylphenyl)cyclopentyl]ethanamine
SMILESCc1ccc(C2CCC(CCN)C2)cc1
InChIInChI=1S/C14H21N/c1-11-2-5-13(6-3-11)14-7-4-12(10-14)8-9-15/h2-3,5-6,12,14H,4,7-10,15H2,1H3
InChIKeyRPJLWSVSSOXWPX-UHFFFAOYSA-N
XLogP3.23
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methylphenyl)cyclopentyl]ethanamine?
The IUPAC name of 2-[3-(4-methylphenyl)cyclopentyl]ethanamine (CID 82282657) is 2-[3-(4-methylphenyl)cyclopentyl]ethanamine.
What is the SMILES notation for 2-[3-(4-methylphenyl)cyclopentyl]ethanamine?
The canonical SMILES for 2-[3-(4-methylphenyl)cyclopentyl]ethanamine is Cc1ccc(C2CCC(CCN)C2)cc1.
What is the InChIKey of 2-[3-(4-methylphenyl)cyclopentyl]ethanamine?
The InChIKey is RPJLWSVSSOXWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11-2-5-13(6-3-11)14-7-4-12(10-14)8-9-15/h2-3,5-6,12,14H,4,7-10,15H2,1H3.
What are the key properties of 2-[3-(4-methylphenyl)cyclopentyl]ethanamine?
2-[3-(4-methylphenyl)cyclopentyl]ethanamine has a molecular weight of 203.33 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methylphenyl)cyclopentyl]ethanamine is sourced from PubChem (CID 82282657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).