2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol

C16H24O2 — CID 103557531

IUPAC2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)CC2(OC)CCC2)cc1
InChIInChI=1S/C16H24O2/c1-3-5-13-6-8-14(9-7-13)15(17)12-16(18-2)10-4-11-16/h6-9,15,17H,3-5,10-12H2,1-2H3
InChIKeyXEZXBBKWESIDLZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.63
Rot. Bonds6

About 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol

2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol (PubChem CID 103557531) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol.

Molecular Properties

Compound Name2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol
PubChem CID103557531
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)CC2(OC)CCC2)cc1
InChIInChI=1S/C16H24O2/c1-3-5-13-6-8-14(9-7-13)15(17)12-16(18-2)10-4-11-16/h6-9,15,17H,3-5,10-12H2,1-2H3
InChIKeyXEZXBBKWESIDLZ-UHFFFAOYSA-N
XLogP3.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-2-(1-methoxycyclobutyl)ethanol
CID 103557502
1-(4-bromophenyl)-2-(1-methoxycyclobutyl)ethanol
CID 103557499
N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine
CID 103556238
6-[1-hydroxy-2-(1-methoxycyclobutyl)ethyl]-1,4-dihydroquinoxaline-2,3-dione
CID 103557518
1-(3-cyclobutylphenyl)-2-(1-methoxycyclobutyl)ethanol
CID 103560284
1-[hydroxy-(4-propylphenyl)methyl]cycloheptan-1-ol
CID 103452040
1-(5-chlorothiophen-2-yl)-2-(1-methoxycyclobutyl)ethanol
CID 103557536
1-(4-propylphenyl)cyclobutan-1-ol
CID 79080570
(1-methoxy-3-methylcyclohexyl)-(4-propylphenyl)methanol
CID 116754992
2-(methylamino)-1-(4-propylphenyl)ethanol
CID 64988870
1-(1-ethylimidazol-2-yl)-2-(1-methoxycyclobutyl)ethanol
CID 103560119
1-(4-butylphenyl)-2-(1-methoxycyclobutyl)ethanone
CID 103555876

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol?
The IUPAC name of 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol (CID 103557531) is 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol.
What is the SMILES notation for 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol?
The canonical SMILES for 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol is CCCc1ccc(C(O)CC2(OC)CCC2)cc1.
What is the InChIKey of 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol?
The InChIKey is XEZXBBKWESIDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-3-5-13-6-8-14(9-7-13)15(17)12-16(18-2)10-4-11-16/h6-9,15,17H,3-5,10-12H2,1-2H3.
What are the key properties of 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol?
2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol has a molecular weight of 248.37 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)-1-(4-propylphenyl)ethanol is sourced from PubChem (CID 103557531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).