2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol

C13H19NO2 — CID 60713485

IUPAC2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol
SMILESCOc1ccccc1CNC1CCCC1O
InChIInChI=1S/C13H19NO2/c1-16-13-8-3-2-5-10(13)9-14-11-6-4-7-12(11)15/h2-3,5,8,11-12,14-15H,4,6-7,9H2,1H3
InChIKeyGYBPHKPEYPENBT-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.70
Rot. Bonds4

About 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol

2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol (PubChem CID 60713485) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol
PubChem CID60713485
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol
SMILESCOc1ccccc1CNC1CCCC1O
InChIInChI=1S/C13H19NO2/c1-16-13-8-3-2-5-10(13)9-14-11-6-4-7-12(11)15/h2-3,5,8,11-12,14-15H,4,6-7,9H2,1H3
InChIKeyGYBPHKPEYPENBT-UHFFFAOYSA-N
XLogP1.70
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol?
The IUPAC name of 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol (CID 60713485) is 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol is COc1ccccc1CNC1CCCC1O.
What is the InChIKey of 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol?
The InChIKey is GYBPHKPEYPENBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-16-13-8-3-2-5-10(13)9-14-11-6-4-7-12(11)15/h2-3,5,8,11-12,14-15H,4,6-7,9H2,1H3.
What are the key properties of 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol?
2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol has a molecular weight of 221.30 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol is sourced from PubChem (CID 60713485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).