[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol

C13H17ClO2 — CID 138485153

IUPAC[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol
SMILESOCc1cc(Cl)cc(OCC2CCCC2)c1
InChIInChI=1S/C13H17ClO2/c14-12-5-11(8-15)6-13(7-12)16-9-10-3-1-2-4-10/h5-7,10,15H,1-4,8-9H2
InChIKeyRLOURCUMZPNWAP-UHFFFAOYSA-N
MW240.73 g/mol
LogP3.40
Rot. Bonds4

About [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol

[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol (PubChem CID 138485153) has the molecular formula C13H17ClO2 and a molecular weight of 240.73 g/mol. Its IUPAC name is [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol
PubChem CID138485153
Molecular FormulaC13H17ClO2
Molecular Weight240.73 g/mol
Exact Mass240.09
IUPAC Name[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol
SMILESOCc1cc(Cl)cc(OCC2CCCC2)c1
InChIInChI=1S/C13H17ClO2/c14-12-5-11(8-15)6-13(7-12)16-9-10-3-1-2-4-10/h5-7,10,15H,1-4,8-9H2
InChIKeyRLOURCUMZPNWAP-UHFFFAOYSA-N
XLogP3.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-chloro-5-[(3-chlorocyclopentyl)methoxy]phenyl]methanol
CID 143728042
[3-bromo-5-(cyclopentylmethoxy)phenyl]methanol
CID 162342873
1-[3-chloro-5-(cyclobutylmethoxy)phenyl]-2-methylpropan-2-amine
CID 117423442
1-bromo-3-chloro-5-(cyclohexylmethoxy)benzene
CID 138985972
4-[[3-chloro-5-(cyclobutylmethoxy)phenyl]methyl]piperidine
CID 117474195
1-[[3-chloro-5-(cyclopropylmethoxy)phenyl]methyl]cyclopropan-1-amine
CID 117382912
3-[3-chloro-5-(cyclopropylmethoxy)phenyl]propanoic acid
CID 117389863
[3,5-dibromo-4-(cyclobutylmethoxy)phenyl]methanol
CID 107738957
[3-(cyclopropylmethoxy)-5-(2-methoxyethoxy)phenyl]methanol
CID 67543873
(E)-3-[3-chloro-5-(cyclobutylmethoxy)phenyl]prop-2-en-1-amine
CID 117382831
[3-chloro-4-(cyclopentylmethoxy)-5-methoxyphenyl]methanol
CID 61343380
[4-(cyclobutylmethoxy)-3,5-dimethylphenyl]methanol
CID 65457601

Frequently Asked Questions

What is the IUPAC name of [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol?
The IUPAC name of [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol (CID 138485153) is [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol.
What is the SMILES notation for [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol?
The canonical SMILES for [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol is OCc1cc(Cl)cc(OCC2CCCC2)c1.
What is the InChIKey of [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol?
The InChIKey is RLOURCUMZPNWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClO2/c14-12-5-11(8-15)6-13(7-12)16-9-10-3-1-2-4-10/h5-7,10,15H,1-4,8-9H2.
What are the key properties of [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol?
[3-chloro-5-(cyclopentylmethoxy)phenyl]methanol has a molecular weight of 240.73 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-5-(cyclopentylmethoxy)phenyl]methanol is sourced from PubChem (CID 138485153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).