2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol

C17H26O2 — CID 103165426

IUPAC2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol
SMILESCCOC1CC(CC(O)c2ccc(C(C)C)cc2)C1
InChIInChI=1S/C17H26O2/c1-4-19-16-9-13(10-16)11-17(18)15-7-5-14(6-8-15)12(2)3/h5-8,12-13,16-18H,4,9-11H2,1-3H3
InChIKeyQSZCHWQXBCONLV-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.05
Rot. Bonds6

About 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol

2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol (PubChem CID 103165426) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol
PubChem CID103165426
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol
SMILESCCOC1CC(CC(O)c2ccc(C(C)C)cc2)C1
InChIInChI=1S/C17H26O2/c1-4-19-16-9-13(10-16)11-17(18)15-7-5-14(6-8-15)12(2)3/h5-8,12-13,16-18H,4,9-11H2,1-3H3
InChIKeyQSZCHWQXBCONLV-UHFFFAOYSA-N
XLogP4.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-difluorophenyl)-2-(3-ethoxycyclobutyl)ethanol
CID 103165377
2-(3-ethoxycyclobutyl)-1-(3-ethoxyphenyl)ethanol
CID 103170186
1-(2,6-dimethoxyphenyl)-2-(3-ethoxycyclobutyl)ethanol
CID 103170312
2-(3-ethoxycyclobutyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 103170158
1-(3-cyclopropyloxyphenyl)-2-(3-ethoxycyclobutyl)ethanol
CID 103170310
[1-(4-chlorophenyl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine
CID 103170363
4-amino-3-(4-chlorophenyl)-1-(3-ethoxycyclobutyl)butan-2-ol
CID 103167190
2-(3-ethoxycyclobutyl)-1-(2-methoxyphenyl)ethanol
CID 103169884
2-(3-ethoxycyclobutyl)-1-(1-propylpyrazol-4-yl)ethanol
CID 103169894
2-(3-ethoxycyclobutyl)-1-(3-methylthiophen-2-yl)ethanol
CID 103165435
1-(4-butan-2-ylphenyl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
CID 103162804
1-(3-chloro-4-methylphenyl)-2-(3-ethoxycyclobutyl)ethanamine
CID 107562011

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol (CID 103165426) is 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol is CCOC1CC(CC(O)c2ccc(C(C)C)cc2)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol?
The InChIKey is QSZCHWQXBCONLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-4-19-16-9-13(10-16)11-17(18)15-7-5-14(6-8-15)12(2)3/h5-8,12-13,16-18H,4,9-11H2,1-3H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol?
2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol has a molecular weight of 262.39 g/mol, XLogP of 4.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-1-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 103165426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).