2-methyl-2-(2-phenylmethoxyethyl)oxolane

C14H20O2 — CID 151587954

IUPAC2-methyl-2-(2-phenylmethoxyethyl)oxolane
SMILESCC1(CCOCc2ccccc2)CCCO1
InChIInChI=1S/C14H20O2/c1-14(8-5-10-16-14)9-11-15-12-13-6-3-2-4-7-13/h2-4,6-7H,5,8-12H2,1H3
InChIKeyQHWXUNJAEMHCEV-UHFFFAOYSA-N
MW220.31 g/mol
LogP3.16
Rot. Bonds5

About 2-methyl-2-(2-phenylmethoxyethyl)oxolane

2-methyl-2-(2-phenylmethoxyethyl)oxolane (PubChem CID 151587954) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-methyl-2-(2-phenylmethoxyethyl)oxolane.

Molecular Properties

Compound Name2-methyl-2-(2-phenylmethoxyethyl)oxolane
PubChem CID151587954
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name2-methyl-2-(2-phenylmethoxyethyl)oxolane
SMILESCC1(CCOCc2ccccc2)CCCO1
InChIInChI=1S/C14H20O2/c1-14(8-5-10-16-14)9-11-15-12-13-6-3-2-4-7-13/h2-4,6-7H,5,8-12H2,1H3
InChIKeyQHWXUNJAEMHCEV-UHFFFAOYSA-N
XLogP3.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-2-(2-phenylmethoxyethyl)-1,3-dioxolane
CID 101039125
2-(iodomethyl)-2-(2-phenylmethoxyethyl)-1,3-dioxolane
CID 142703154
2-[1-(iodomethyl)cyclohexyl]ethoxymethylbenzene
CID 142666822
2-methyl-2-(phenylmethoxymethyl)oxirane
CID 4613554
2-[1-(2-phenylmethoxyethyl)cyclohexyl]ethanol
CID 59714985
2,2-bis(phenylmethoxymethyl)-1,3-dioxane
CID 59792450
2-methyl-3-(2-phenylmethoxyethyl)oxolan-3-amine
CID 130537408
3-[2-(2-phenylmethoxyethyl)-1,3-dioxolan-2-yl]propan-1-ol
CID 14395384
2-methyl-2-[(2-methylphenyl)methoxymethyl]oxolane
CID 70569993
2,2-dimethyl-5-(2-phenylmethoxyethyl)-1,3-dioxane
CID 85248081
benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
CID 103393559
N-methyl-1-[1-(2-phenylmethoxyethyl)cyclopropyl]ethanamine
CID 130537033

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-phenylmethoxyethyl)oxolane?
The IUPAC name of 2-methyl-2-(2-phenylmethoxyethyl)oxolane (CID 151587954) is 2-methyl-2-(2-phenylmethoxyethyl)oxolane.
What is the SMILES notation for 2-methyl-2-(2-phenylmethoxyethyl)oxolane?
The canonical SMILES for 2-methyl-2-(2-phenylmethoxyethyl)oxolane is CC1(CCOCc2ccccc2)CCCO1.
What is the InChIKey of 2-methyl-2-(2-phenylmethoxyethyl)oxolane?
The InChIKey is QHWXUNJAEMHCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-14(8-5-10-16-14)9-11-15-12-13-6-3-2-4-7-13/h2-4,6-7H,5,8-12H2,1H3.
What are the key properties of 2-methyl-2-(2-phenylmethoxyethyl)oxolane?
2-methyl-2-(2-phenylmethoxyethyl)oxolane has a molecular weight of 220.31 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-phenylmethoxyethyl)oxolane is sourced from PubChem (CID 151587954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).