1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol

C13H18O2 — CID 105459157

IUPAC1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCOCC1(O)CCCc2cc(C)ccc21
InChIInChI=1S/C13H18O2/c1-10-5-6-12-11(8-10)4-3-7-13(12,14)9-15-2/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyRCNLOJOLEGQLIC-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.17
Rot. Bonds2

About 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol

1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol (PubChem CID 105459157) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol.

Molecular Properties

Compound Name1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol
PubChem CID105459157
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol
SMILESCOCC1(O)CCCc2cc(C)ccc21
InChIInChI=1S/C13H18O2/c1-10-5-6-12-11(8-10)4-3-7-13(12,14)9-15-2/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyRCNLOJOLEGQLIC-UHFFFAOYSA-N
XLogP2.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The IUPAC name of 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol (CID 105459157) is 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol.
What is the SMILES notation for 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The canonical SMILES for 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol is COCC1(O)CCCc2cc(C)ccc21.
What is the InChIKey of 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol?
The InChIKey is RCNLOJOLEGQLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-10-5-6-12-11(8-10)4-3-7-13(12,14)9-15-2/h5-6,8,14H,3-4,7,9H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol?
1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-6-methyl-3,4-dihydro-2H-naphthalen-1-ol is sourced from PubChem (CID 105459157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).