[3-(4-ethylphenyl)cyclopentyl]methanamine

C14H21N — CID 82282659

IUPAC[3-(4-ethylphenyl)cyclopentyl]methanamine
SMILESCCc1ccc(C2CCC(CN)C2)cc1
InChIInChI=1S/C14H21N/c1-2-11-3-6-13(7-4-11)14-8-5-12(9-14)10-15/h3-4,6-7,12,14H,2,5,8-10,15H2,1H3
InChIKeyJKOPASGIDNYNHX-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.09
Rot. Bonds3

About [3-(4-ethylphenyl)cyclopentyl]methanamine

[3-(4-ethylphenyl)cyclopentyl]methanamine (PubChem CID 82282659) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is [3-(4-ethylphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[3-(4-ethylphenyl)cyclopentyl]methanamine
PubChem CID82282659
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name[3-(4-ethylphenyl)cyclopentyl]methanamine
SMILESCCc1ccc(C2CCC(CN)C2)cc1
InChIInChI=1S/C14H21N/c1-2-11-3-6-13(7-4-11)14-8-5-12(9-14)10-15/h3-4,6-7,12,14H,2,5,8-10,15H2,1H3
InChIKeyJKOPASGIDNYNHX-UHFFFAOYSA-N
XLogP3.09
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 ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [3-(4-ethylphenyl)cyclopentyl]methanamine?
The IUPAC name of [3-(4-ethylphenyl)cyclopentyl]methanamine (CID 82282659) is [3-(4-ethylphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [3-(4-ethylphenyl)cyclopentyl]methanamine?
The canonical SMILES for [3-(4-ethylphenyl)cyclopentyl]methanamine is CCc1ccc(C2CCC(CN)C2)cc1.
What is the InChIKey of [3-(4-ethylphenyl)cyclopentyl]methanamine?
The InChIKey is JKOPASGIDNYNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-2-11-3-6-13(7-4-11)14-8-5-12(9-14)10-15/h3-4,6-7,12,14H,2,5,8-10,15H2,1H3.
What are the key properties of [3-(4-ethylphenyl)cyclopentyl]methanamine?
[3-(4-ethylphenyl)cyclopentyl]methanamine has a molecular weight of 203.33 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-ethylphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 82282659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).