(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol

C16H22O2 — CID 107193013

IUPAC(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol
SMILESCC1CCCC1C(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H22O2/c1-11-4-2-7-15(11)16(17)12-5-3-6-14(10-12)18-13-8-9-13/h3,5-6,10-11,13,15-17H,2,4,7-9H2,1H3
InChIKeyLIDAPKFDXLHEBT-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.70
Rot. Bonds4

About (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol

(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol (PubChem CID 107193013) has the molecular formula C16H22O2 and a molecular weight of 246.35 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol
PubChem CID107193013
Molecular FormulaC16H22O2
Molecular Weight246.35 g/mol
Exact Mass246.16
IUPAC Name(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol
SMILESCC1CCCC1C(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H22O2/c1-11-4-2-7-15(11)16(17)12-5-3-6-14(10-12)18-13-8-9-13/h3,5-6,10-11,13,15-17H,2,4,7-9H2,1H3
InChIKeyLIDAPKFDXLHEBT-UHFFFAOYSA-N
XLogP3.70
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-bicyclo[4.1.0]heptanyl-(3-cyclopropyloxyphenyl)methanol
CID 115838516
N-[(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methyl]ethanamine
CID 107191373
N-[(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methyl]propan-1-amine
CID 107191379
(3-cyclopropyloxyphenyl)-(3,5-dimethylcyclohex-3-en-1-yl)methanol
CID 103277476
1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105131484
1-cyclopentyloxy-3-propan-2-ylbenzene
CID 140909564
(4-methoxyphenyl)-(2-methylcyclopentyl)methanol
CID 107181512
(3-cyclopropyloxyphenyl)-(3-iodophenyl)methanol
CID 115838435
3-(3-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618801
ethyl 2-(3-cyclopentyloxyphenyl)-2-hydroxyacetate
CID 117415048
(3-cyclopropyloxyphenyl)-(1-methoxycycloheptyl)methanol
CID 114521465
1-[3-(oxan-4-yloxy)phenyl]ethanol
CID 63935830

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol?
The IUPAC name of (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol (CID 107193013) is (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol is CC1CCCC1C(O)c1cccc(OC2CC2)c1.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol?
The InChIKey is LIDAPKFDXLHEBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O2/c1-11-4-2-7-15(11)16(17)12-5-3-6-14(10-12)18-13-8-9-13/h3,5-6,10-11,13,15-17H,2,4,7-9H2,1H3.
What are the key properties of (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol?
(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol has a molecular weight of 246.35 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol is sourced from PubChem (CID 107193013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).