(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol

C14H20O2 — CID 115823866

IUPAC(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol
SMILESCCc1cccc(C(O)C2COC(C)C2)c1
InChIInChI=1S/C14H20O2/c1-3-11-5-4-6-12(8-11)14(15)13-7-10(2)16-9-13/h4-6,8,10,13-15H,3,7,9H2,1-2H3
InChIKeyPPXUBSUIYNSRFF-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.71
Rot. Bonds3

About (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol

(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol (PubChem CID 115823866) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol
PubChem CID115823866
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol
SMILESCCc1cccc(C(O)C2COC(C)C2)c1
InChIInChI=1S/C14H20O2/c1-3-11-5-4-6-12(8-11)14(15)13-7-10(2)16-9-13/h4-6,8,10,13-15H,3,7,9H2,1-2H3
InChIKeyPPXUBSUIYNSRFF-UHFFFAOYSA-N
XLogP2.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-difluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826691
(3-ethylphenyl)-(5-methyloxolan-2-yl)methanol
CID 82837003
(4-chlorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826660
(3-bromo-4-fluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 114826764
(R)-cyclopropyl-(3-ethylphenyl)methanamine
CID 55277646
(S)-cyclopropyl-(3-ethylphenyl)methanamine
CID 131196510
1-(5-methyloxolan-3-yl)propan-1-ol
CID 115787725
N-ethyl-1-(5-methyloxolan-3-yl)-2-(3-methylphenyl)ethanamine
CID 114825892
(5-methyloxolan-3-yl)-(2-propan-2-yloxyphenyl)methanol
CID 115823707
(2-chlorothiophen-3-yl)-(5-methyloxolan-3-yl)methanol
CID 130655294
(5-bromo-2-fluorophenyl)-(5-methyloxolan-3-yl)methanol
CID 115820673
7-[hydroxy-(5-methyloxolan-3-yl)methyl]-2-methyl-4H-isoquinoline-1,3-dione
CID 114826743

Frequently Asked Questions

What is the IUPAC name of (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol?
The IUPAC name of (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol (CID 115823866) is (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol.
What is the SMILES notation for (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol?
The canonical SMILES for (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol is CCc1cccc(C(O)C2COC(C)C2)c1.
What is the InChIKey of (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol?
The InChIKey is PPXUBSUIYNSRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-3-11-5-4-6-12(8-11)14(15)13-7-10(2)16-9-13/h4-6,8,10,13-15H,3,7,9H2,1-2H3.
What are the key properties of (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol?
(3-ethylphenyl)-(5-methyloxolan-3-yl)methanol has a molecular weight of 220.31 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylphenyl)-(5-methyloxolan-3-yl)methanol is sourced from PubChem (CID 115823866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).