1-(methoxymethyl)-4-methylnaphthalene

C13H14O — CID 3018091

IUPAC1-(methoxymethyl)-4-methylnaphthalene
SMILESCOCc1ccc(C)c2ccccc12
InChIInChI=1S/C13H14O/c1-10-7-8-11(9-14-2)13-6-4-3-5-12(10)13/h3-8H,9H2,1-2H3
InChIKeyCDZSYRIMGYFGKR-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.29
Rot. Bonds2

About 1-(methoxymethyl)-4-methylnaphthalene

1-(methoxymethyl)-4-methylnaphthalene (PubChem CID 3018091) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-(methoxymethyl)-4-methylnaphthalene.

Molecular Properties

Compound Name1-(methoxymethyl)-4-methylnaphthalene
PubChem CID3018091
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name1-(methoxymethyl)-4-methylnaphthalene
SMILESCOCc1ccc(C)c2ccccc12
InChIInChI=1S/C13H14O/c1-10-7-8-11(9-14-2)13-6-4-3-5-12(10)13/h3-8H,9H2,1-2H3
InChIKeyCDZSYRIMGYFGKR-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-4-methylnaphthalene?
The IUPAC name of 1-(methoxymethyl)-4-methylnaphthalene (CID 3018091) is 1-(methoxymethyl)-4-methylnaphthalene.
What is the SMILES notation for 1-(methoxymethyl)-4-methylnaphthalene?
The canonical SMILES for 1-(methoxymethyl)-4-methylnaphthalene is COCc1ccc(C)c2ccccc12.
What is the InChIKey of 1-(methoxymethyl)-4-methylnaphthalene?
The InChIKey is CDZSYRIMGYFGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-10-7-8-11(9-14-2)13-6-4-3-5-12(10)13/h3-8H,9H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-4-methylnaphthalene?
1-(methoxymethyl)-4-methylnaphthalene has a molecular weight of 186.25 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-4-methylnaphthalene is sourced from PubChem (CID 3018091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).