[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol

C15H22O — CID 66024135

IUPAC[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol
SMILESCc1cc(C)cc(CC2(CO)CCCC2)c1
InChIInChI=1S/C15H22O/c1-12-7-13(2)9-14(8-12)10-15(11-16)5-3-4-6-15/h7-9,16H,3-6,10-11H2,1-2H3
InChIKeyCXXKLZZYODLOAJ-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.40
Rot. Bonds3

About [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol

[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol (PubChem CID 66024135) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol
PubChem CID66024135
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol
SMILESCc1cc(C)cc(CC2(CO)CCCC2)c1
InChIInChI=1S/C15H22O/c1-12-7-13(2)9-14(8-12)10-15(11-16)5-3-4-6-15/h7-9,16H,3-6,10-11H2,1-2H3
InChIKeyCXXKLZZYODLOAJ-UHFFFAOYSA-N
XLogP3.40
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol?
The IUPAC name of [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol (CID 66024135) is [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol is Cc1cc(C)cc(CC2(CO)CCCC2)c1.
What is the InChIKey of [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol?
The InChIKey is CXXKLZZYODLOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-12-7-13(2)9-14(8-12)10-15(11-16)5-3-4-6-15/h7-9,16H,3-6,10-11H2,1-2H3.
What are the key properties of [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol?
[1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol has a molecular weight of 218.34 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3,5-dimethylphenyl)methyl]cyclopentyl]methanol is sourced from PubChem (CID 66024135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).