1-(2-methoxyethyl)naphthalene

C13H14O — CID 15635901

IUPAC1-(2-methoxyethyl)naphthalene
SMILESCOCCc1cccc2ccccc12
InChIInChI=1S/C13H14O/c1-14-10-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8H,9-10H2,1H3
InChIKeyXZYRORPHKKTRJT-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.03
Rot. Bonds3

About 1-(2-methoxyethyl)naphthalene

1-(2-methoxyethyl)naphthalene (PubChem CID 15635901) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-(2-methoxyethyl)naphthalene.

Molecular Properties

Compound Name1-(2-methoxyethyl)naphthalene
PubChem CID15635901
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name1-(2-methoxyethyl)naphthalene
SMILESCOCCc1cccc2ccccc12
InChIInChI=1S/C13H14O/c1-14-10-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8H,9-10H2,1H3
InChIKeyXZYRORPHKKTRJT-UHFFFAOYSA-N
XLogP3.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)naphthalene?
The IUPAC name of 1-(2-methoxyethyl)naphthalene (CID 15635901) is 1-(2-methoxyethyl)naphthalene.
What is the SMILES notation for 1-(2-methoxyethyl)naphthalene?
The canonical SMILES for 1-(2-methoxyethyl)naphthalene is COCCc1cccc2ccccc12.
What is the InChIKey of 1-(2-methoxyethyl)naphthalene?
The InChIKey is XZYRORPHKKTRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-14-10-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8H,9-10H2,1H3.
What are the key properties of 1-(2-methoxyethyl)naphthalene?
1-(2-methoxyethyl)naphthalene has a molecular weight of 186.25 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)naphthalene is sourced from PubChem (CID 15635901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).