[1-(4-methoxyphenyl)cyclopentyl]methanamine

C13H19NO — CID 745023

IUPAC[1-(4-methoxyphenyl)cyclopentyl]methanamine
SMILESCOc1ccc(C2(CN)CCCC2)cc1
InChIInChI=1S/C13H19NO/c1-15-12-6-4-11(5-7-12)13(10-14)8-2-3-9-13/h4-7H,2-3,8-10,14H2,1H3
InChIKeyWSNHLIUOCLAAMP-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.47
Rot. Bonds3

About [1-(4-methoxyphenyl)cyclopentyl]methanamine

[1-(4-methoxyphenyl)cyclopentyl]methanamine (PubChem CID 745023) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is [1-(4-methoxyphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(4-methoxyphenyl)cyclopentyl]methanamine
PubChem CID745023
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name[1-(4-methoxyphenyl)cyclopentyl]methanamine
SMILESCOc1ccc(C2(CN)CCCC2)cc1
InChIInChI=1S/C13H19NO/c1-15-12-6-4-11(5-7-12)13(10-14)8-2-3-9-13/h4-7H,2-3,8-10,14H2,1H3
InChIKeyWSNHLIUOCLAAMP-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxyphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(4-methoxyphenyl)cyclopentyl]methanamine (CID 745023) is [1-(4-methoxyphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(4-methoxyphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(4-methoxyphenyl)cyclopentyl]methanamine is COc1ccc(C2(CN)CCCC2)cc1.
What is the InChIKey of [1-(4-methoxyphenyl)cyclopentyl]methanamine?
The InChIKey is WSNHLIUOCLAAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-15-12-6-4-11(5-7-12)13(10-14)8-2-3-9-13/h4-7H,2-3,8-10,14H2,1H3.
What are the key properties of [1-(4-methoxyphenyl)cyclopentyl]methanamine?
[1-(4-methoxyphenyl)cyclopentyl]methanamine has a molecular weight of 205.30 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxyphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 745023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).