(4-chloro-3-methoxyphenyl)-cyclopentylmethanol

C13H17ClO2 — CID 79699326

IUPAC(4-chloro-3-methoxyphenyl)-cyclopentylmethanol
SMILESCOc1cc(C(O)C2CCCC2)ccc1Cl
InChIInChI=1S/C13H17ClO2/c1-16-12-8-10(6-7-11(12)14)13(15)9-4-2-3-5-9/h6-9,13,15H,2-5H2,1H3
InChIKeyFUZOYRCGECLMIY-UHFFFAOYSA-N
MW240.73 g/mol
LogP3.57
Rot. Bonds3

About (4-chloro-3-methoxyphenyl)-cyclopentylmethanol

(4-chloro-3-methoxyphenyl)-cyclopentylmethanol (PubChem CID 79699326) has the molecular formula C13H17ClO2 and a molecular weight of 240.73 g/mol. Its IUPAC name is (4-chloro-3-methoxyphenyl)-cyclopentylmethanol.

Molecular Properties

Compound Name(4-chloro-3-methoxyphenyl)-cyclopentylmethanol
PubChem CID79699326
Molecular FormulaC13H17ClO2
Molecular Weight240.73 g/mol
Exact Mass240.09
IUPAC Name(4-chloro-3-methoxyphenyl)-cyclopentylmethanol
SMILESCOc1cc(C(O)C2CCCC2)ccc1Cl
InChIInChI=1S/C13H17ClO2/c1-16-12-8-10(6-7-11(12)14)13(15)9-4-2-3-5-9/h6-9,13,15H,2-5H2,1H3
InChIKeyFUZOYRCGECLMIY-UHFFFAOYSA-N
XLogP3.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-chloro-4-methoxyphenyl)-cycloheptylmethanol
CID 62590019
(4-chloro-3-methoxyphenyl)-(thian-3-yl)methanol
CID 114283113
(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methanol
CID 105111122
(3-chloro-4,5-dimethoxyphenyl)-cyclopentylmethanol
CID 54878443
cycloheptyl-(4-fluoro-3-methoxyphenyl)methanol
CID 115829463
(3-chloro-4,5-dimethoxyphenyl)-cycloheptylmethanol
CID 82931298
cyclooctyl-(3,4-dichlorophenyl)methanol
CID 65023087
1-(4-chloro-3-methoxyphenyl)-1-cyclooctyl-N-methylmethanamine
CID 80604128
cyclohexyl-(3,4,5-trimethoxyphenyl)methanol
CID 63895814
(3-chloro-4-methoxyphenyl)-(3-methylcyclohexyl)methanol
CID 65026372
(4-chloro-3-methoxyphenyl)-(5-methyloxolan-2-yl)methanol
CID 82838251
(4-chloro-3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 79697209

Frequently Asked Questions

What is the IUPAC name of (4-chloro-3-methoxyphenyl)-cyclopentylmethanol?
The IUPAC name of (4-chloro-3-methoxyphenyl)-cyclopentylmethanol (CID 79699326) is (4-chloro-3-methoxyphenyl)-cyclopentylmethanol.
What is the SMILES notation for (4-chloro-3-methoxyphenyl)-cyclopentylmethanol?
The canonical SMILES for (4-chloro-3-methoxyphenyl)-cyclopentylmethanol is COc1cc(C(O)C2CCCC2)ccc1Cl.
What is the InChIKey of (4-chloro-3-methoxyphenyl)-cyclopentylmethanol?
The InChIKey is FUZOYRCGECLMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClO2/c1-16-12-8-10(6-7-11(12)14)13(15)9-4-2-3-5-9/h6-9,13,15H,2-5H2,1H3.
What are the key properties of (4-chloro-3-methoxyphenyl)-cyclopentylmethanol?
(4-chloro-3-methoxyphenyl)-cyclopentylmethanol has a molecular weight of 240.73 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-3-methoxyphenyl)-cyclopentylmethanol is sourced from PubChem (CID 79699326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).