(2-chlorophenyl)-(1-methoxycyclopentyl)methanol

C13H17ClO2 — CID 104610373

IUPAC(2-chlorophenyl)-(1-methoxycyclopentyl)methanol
SMILESCOC1(C(O)c2ccccc2Cl)CCCC1
InChIInChI=1S/C13H17ClO2/c1-16-13(8-4-5-9-13)12(15)10-6-2-3-7-11(10)14/h2-3,6-7,12,15H,4-5,8-9H2,1H3
InChIKeyCGVWSYDHIAEMSF-UHFFFAOYSA-N
MW240.73 g/mol
LogP3.33
Rot. Bonds3

About (2-chlorophenyl)-(1-methoxycyclopentyl)methanol

(2-chlorophenyl)-(1-methoxycyclopentyl)methanol (PubChem CID 104610373) has the molecular formula C13H17ClO2 and a molecular weight of 240.73 g/mol. Its IUPAC name is (2-chlorophenyl)-(1-methoxycyclopentyl)methanol.

Molecular Properties

Compound Name(2-chlorophenyl)-(1-methoxycyclopentyl)methanol
PubChem CID104610373
Molecular FormulaC13H17ClO2
Molecular Weight240.73 g/mol
Exact Mass240.09
IUPAC Name(2-chlorophenyl)-(1-methoxycyclopentyl)methanol
SMILESCOC1(C(O)c2ccccc2Cl)CCCC1
InChIInChI=1S/C13H17ClO2/c1-16-13(8-4-5-9-13)12(15)10-6-2-3-7-11(10)14/h2-3,6-7,12,15H,4-5,8-9H2,1H3
InChIKeyCGVWSYDHIAEMSF-UHFFFAOYSA-N
XLogP3.33
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 ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,5-dichlorophenyl)-(1-methoxycyclopentyl)methanol
CID 104610351
(2-fluorophenyl)-(1-methoxycycloheptyl)methanol
CID 116755788
(5-chloro-2-methoxyphenyl)-(1-methoxycycloheptyl)methanol
CID 116756025
(2,3-dimethylphenyl)-(1-methoxycycloheptyl)methanol
CID 116755970
(1-methoxycyclohexyl)-phenylmethanol
CID 116753267
(2-fluoro-3-methoxyphenyl)-(1-methoxycyclopentyl)methanol
CID 104610503
(1-methoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753417
(1-methoxycyclohexyl)-[2-(2-methoxyethoxy)phenyl]methanol
CID 116753305
(2-chlorophenyl)-(1-phenylcyclohexyl)methanol
CID 63414657
N-[(2-chlorophenyl)-(1-methoxycyclohexyl)methyl]propan-1-amine
CID 116763409
2-(2-chlorophenyl)sulfanyl-1-(1-methoxycyclohexyl)ethanol
CID 116779685
(2,5-difluorophenyl)-(1-methoxycycloheptyl)methanol
CID 116756000

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(1-methoxycyclopentyl)methanol?
The IUPAC name of (2-chlorophenyl)-(1-methoxycyclopentyl)methanol (CID 104610373) is (2-chlorophenyl)-(1-methoxycyclopentyl)methanol.
What is the SMILES notation for (2-chlorophenyl)-(1-methoxycyclopentyl)methanol?
The canonical SMILES for (2-chlorophenyl)-(1-methoxycyclopentyl)methanol is COC1(C(O)c2ccccc2Cl)CCCC1.
What is the InChIKey of (2-chlorophenyl)-(1-methoxycyclopentyl)methanol?
The InChIKey is CGVWSYDHIAEMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClO2/c1-16-13(8-4-5-9-13)12(15)10-6-2-3-7-11(10)14/h2-3,6-7,12,15H,4-5,8-9H2,1H3.
What are the key properties of (2-chlorophenyl)-(1-methoxycyclopentyl)methanol?
(2-chlorophenyl)-(1-methoxycyclopentyl)methanol has a molecular weight of 240.73 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(1-methoxycyclopentyl)methanol is sourced from PubChem (CID 104610373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).