[1-(2-methoxyphenyl)cyclopentyl]methanol

C13H18O2 — CID 83687614

IUPAC[1-(2-methoxyphenyl)cyclopentyl]methanol
SMILESCOc1ccccc1C1(CO)CCCC1
InChIInChI=1S/C13H18O2/c1-15-12-7-3-2-6-11(12)13(10-14)8-4-5-9-13/h2-3,6-7,14H,4-5,8-10H2,1H3
InChIKeyNKWSTXRABQEENE-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.50
Rot. Bonds3

About [1-(2-methoxyphenyl)cyclopentyl]methanol

[1-(2-methoxyphenyl)cyclopentyl]methanol (PubChem CID 83687614) has the molecular formula C13H18O2 and a molecular weight of 206.29 g/mol. Its IUPAC name is [1-(2-methoxyphenyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(2-methoxyphenyl)cyclopentyl]methanol
PubChem CID83687614
Molecular FormulaC13H18O2
Molecular Weight206.29 g/mol
Exact Mass206.13
IUPAC Name[1-(2-methoxyphenyl)cyclopentyl]methanol
SMILESCOc1ccccc1C1(CO)CCCC1
InChIInChI=1S/C13H18O2/c1-15-12-7-3-2-6-11(12)13(10-14)8-4-5-9-13/h2-3,6-7,14H,4-5,8-10H2,1H3
InChIKeyNKWSTXRABQEENE-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyphenyl)cyclopentyl]methanol?
The IUPAC name of [1-(2-methoxyphenyl)cyclopentyl]methanol (CID 83687614) is [1-(2-methoxyphenyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(2-methoxyphenyl)cyclopentyl]methanol?
The canonical SMILES for [1-(2-methoxyphenyl)cyclopentyl]methanol is COc1ccccc1C1(CO)CCCC1.
What is the InChIKey of [1-(2-methoxyphenyl)cyclopentyl]methanol?
The InChIKey is NKWSTXRABQEENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-15-12-7-3-2-6-11(12)13(10-14)8-4-5-9-13/h2-3,6-7,14H,4-5,8-10H2,1H3.
What are the key properties of [1-(2-methoxyphenyl)cyclopentyl]methanol?
[1-(2-methoxyphenyl)cyclopentyl]methanol has a molecular weight of 206.29 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyphenyl)cyclopentyl]methanol is sourced from PubChem (CID 83687614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).