2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol

C16H24O2 — CID 61086888

IUPAC2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccc(C(O)CC2CCCC2)cc1
InChIInChI=1S/C16H24O2/c1-12(2)18-15-9-7-14(8-10-15)16(17)11-13-5-3-4-6-13/h7-10,12-13,16-17H,3-6,11H2,1-2H3
InChIKeyBTUSIOJEBRWJPJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP4.09
Rot. Bonds5

About 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol

2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol (PubChem CID 61086888) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol
PubChem CID61086888
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccc(C(O)CC2CCCC2)cc1
InChIInChI=1S/C16H24O2/c1-12(2)18-15-9-7-14(8-10-15)16(17)11-13-5-3-4-6-13/h7-10,12-13,16-17H,3-6,11H2,1-2H3
InChIKeyBTUSIOJEBRWJPJ-UHFFFAOYSA-N
XLogP4.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-1-[4-(difluoromethoxy)phenyl]ethanol
CID 65150469
2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol
CID 65145450
2-cyclopentyl-1-(4-ethoxyphenyl)ethanol
CID 61101248
2-cyclopentyl-1-(4-cyclopropyloxyphenyl)ethanol
CID 115838412
2-(2-cyclobutylethoxy)-1-(4-propan-2-yloxyphenyl)ethanol
CID 106204040
1-(4-aminophenyl)-2-cyclopentylethanol
CID 106695429
2-cyclopentyl-1-[4-(difluoromethyl)phenyl]ethanol
CID 115525070
3-[cyclohexyl(methyl)amino]-1-(4-propan-2-yloxyphenyl)propan-1-ol
CID 82073844
2-cyclopentyl-1-phenylethanol
CID 15629098
2-cyclopentyl-1-[4-(dimethylamino)phenyl]ethanol
CID 65151167
1-(4-propan-2-yloxyphenyl)butan-1-ol
CID 22486858
1-(4-aminophenyl)-2-cyclobutylethanol
CID 106695629

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol?
The IUPAC name of 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol (CID 61086888) is 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol.
What is the SMILES notation for 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol?
The canonical SMILES for 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol is CC(C)Oc1ccc(C(O)CC2CCCC2)cc1.
What is the InChIKey of 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol?
The InChIKey is BTUSIOJEBRWJPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-12(2)18-15-9-7-14(8-10-15)16(17)11-13-5-3-4-6-13/h7-10,12-13,16-17H,3-6,11H2,1-2H3.
What are the key properties of 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol?
2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol has a molecular weight of 248.37 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol is sourced from PubChem (CID 61086888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).