[1-(3-chlorophenoxy)cyclopentyl]methanol

C12H15ClO2 — CID 82128232

IUPAC[1-(3-chlorophenoxy)cyclopentyl]methanol
SMILESOCC1(Oc2cccc(Cl)c2)CCCC1
InChIInChI=1S/C12H15ClO2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,14H,1-2,6-7,9H2
InChIKeyJKWRXKJXEPZFLN-UHFFFAOYSA-N
MW226.70 g/mol
LogP3.02
Rot. Bonds3

About [1-(3-chlorophenoxy)cyclopentyl]methanol

[1-(3-chlorophenoxy)cyclopentyl]methanol (PubChem CID 82128232) has the molecular formula C12H15ClO2 and a molecular weight of 226.70 g/mol. Its IUPAC name is [1-(3-chlorophenoxy)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(3-chlorophenoxy)cyclopentyl]methanol
PubChem CID82128232
Molecular FormulaC12H15ClO2
Molecular Weight226.70 g/mol
Exact Mass226.08
IUPAC Name[1-(3-chlorophenoxy)cyclopentyl]methanol
SMILESOCC1(Oc2cccc(Cl)c2)CCCC1
InChIInChI=1S/C12H15ClO2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,14H,1-2,6-7,9H2
InChIKeyJKWRXKJXEPZFLN-UHFFFAOYSA-N
XLogP3.02
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.70
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 115362360
2-[1-[[[2-(3-chlorophenoxy)acetyl]amino]methyl]cyclobutyl]acetic acid
CID 81163585
[1-(3-ethoxyphenoxy)cyclohexyl]methanamine
CID 94689943
[1-(3-chloroanilino)cyclohexyl]methanol
CID 61050342
[1-(3-chloroanilino)cyclooctyl]methanol
CID 63428436
2-(3-chlorophenoxy)propane-1,3-diol
CID 137319969
1-[[1-(bromomethyl)cyclobutyl]methoxy]-3-chlorobenzene
CID 65007522
(3-chlorophenyl) 2-hydroxyacetate
CID 130620336
1-amino-N-[2-(3-chlorophenoxy)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119295699
1-[amino-(3-chlorophenyl)methyl]cyclohexan-1-ol
CID 121281370
1-(3-chlorophenyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559094
1-[(3-chlorophenyl)methyl]cyclopentan-1-ol
CID 60798466

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorophenoxy)cyclopentyl]methanol?
The IUPAC name of [1-(3-chlorophenoxy)cyclopentyl]methanol (CID 82128232) is [1-(3-chlorophenoxy)cyclopentyl]methanol.
What is the SMILES notation for [1-(3-chlorophenoxy)cyclopentyl]methanol?
The canonical SMILES for [1-(3-chlorophenoxy)cyclopentyl]methanol is OCC1(Oc2cccc(Cl)c2)CCCC1.
What is the InChIKey of [1-(3-chlorophenoxy)cyclopentyl]methanol?
The InChIKey is JKWRXKJXEPZFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClO2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,14H,1-2,6-7,9H2.
What are the key properties of [1-(3-chlorophenoxy)cyclopentyl]methanol?
[1-(3-chlorophenoxy)cyclopentyl]methanol has a molecular weight of 226.70 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorophenoxy)cyclopentyl]methanol is sourced from PubChem (CID 82128232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).