1-(2-methoxyethoxy)-4-methylnaphthalene

C14H16O2 — CID 90431362

IUPAC1-(2-methoxyethoxy)-4-methylnaphthalene
SMILESCOCCOc1ccc(C)c2ccccc12
InChIInChI=1S/C14H16O2/c1-11-7-8-14(16-10-9-15-2)13-6-4-3-5-12(11)13/h3-8H,9-10H2,1-2H3
InChIKeyMCCHICJIAUYACD-UHFFFAOYSA-N
MW216.28 g/mol
LogP3.17
Rot. Bonds4

About 1-(2-methoxyethoxy)-4-methylnaphthalene

1-(2-methoxyethoxy)-4-methylnaphthalene (PubChem CID 90431362) has the molecular formula C14H16O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-4-methylnaphthalene.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-4-methylnaphthalene
PubChem CID90431362
Molecular FormulaC14H16O2
Molecular Weight216.28 g/mol
Exact Mass216.12
IUPAC Name1-(2-methoxyethoxy)-4-methylnaphthalene
SMILESCOCCOc1ccc(C)c2ccccc12
InChIInChI=1S/C14H16O2/c1-11-7-8-14(16-10-9-15-2)13-6-4-3-5-12(11)13/h3-8H,9-10H2,1-2H3
InChIKeyMCCHICJIAUYACD-UHFFFAOYSA-N
XLogP3.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(2-methoxyethoxy)-4-methylnaphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-methylnaphthalen-1-yl)oxypropan-1-ol
CID 15349996
3-(4-methylnaphthalen-1-yl)oxy-1-phenylpropan-1-amine
CID 19884969
1-[2-(4-methylnaphthalen-1-yl)oxyethyl]piperidine
CID 71054217
1-(2-cyclohexylethoxy)-4-methylnaphthalene
CID 123891413
2-[(4-methylnaphthalen-1-yl)oxymethyl]aniline
CID 166926347
1-[4-(2-methoxyethoxy)naphthalen-1-yl]-1,4-dithian-1-ium
CID 140816164
2-(2-methoxyethoxy)-3-methylaniline
CID 115550862
2-[2-[5-(2-methoxyethoxy)naphthalen-1-yl]oxyethoxy]ethanol
CID 58864087
1,4-dibutoxynaphthalene
CID 22016411
4-[2-(3-methoxypropoxy)ethoxy]naphthalen-1-amine
CID 103177326
2-[2-(2-methoxyethoxy)ethoxy]-1,3-dimethylbenzene
CID 83057558
1-ethenyl-2-(2-methoxyethoxy)naphthalene
CID 176513404

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-4-methylnaphthalene?
The IUPAC name of 1-(2-methoxyethoxy)-4-methylnaphthalene (CID 90431362) is 1-(2-methoxyethoxy)-4-methylnaphthalene.
What is the SMILES notation for 1-(2-methoxyethoxy)-4-methylnaphthalene?
The canonical SMILES for 1-(2-methoxyethoxy)-4-methylnaphthalene is COCCOc1ccc(C)c2ccccc12.
What is the InChIKey of 1-(2-methoxyethoxy)-4-methylnaphthalene?
The InChIKey is MCCHICJIAUYACD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O2/c1-11-7-8-14(16-10-9-15-2)13-6-4-3-5-12(11)13/h3-8H,9-10H2,1-2H3.
What are the key properties of 1-(2-methoxyethoxy)-4-methylnaphthalene?
1-(2-methoxyethoxy)-4-methylnaphthalene has a molecular weight of 216.28 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-4-methylnaphthalene is sourced from PubChem (CID 90431362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).