2-benzyl-6-(methoxymethoxy)naphthalene

C19H18O2 — CID 132602813

IUPAC2-benzyl-6-(methoxymethoxy)naphthalene
SMILESCOCOc1ccc2cc(Cc3ccccc3)ccc2c1
InChIInChI=1S/C19H18O2/c1-20-14-21-19-10-9-17-12-16(7-8-18(17)13-19)11-15-5-3-2-4-6-15/h2-10,12-13H,11,14H2,1H3
InChIKeyITRUKCYFSMQHDT-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.41
Rot. Bonds5

About 2-benzyl-6-(methoxymethoxy)naphthalene

2-benzyl-6-(methoxymethoxy)naphthalene (PubChem CID 132602813) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-benzyl-6-(methoxymethoxy)naphthalene.

Molecular Properties

Compound Name2-benzyl-6-(methoxymethoxy)naphthalene
PubChem CID132602813
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name2-benzyl-6-(methoxymethoxy)naphthalene
SMILESCOCOc1ccc2cc(Cc3ccccc3)ccc2c1
InChIInChI=1S/C19H18O2/c1-20-14-21-19-10-9-17-12-16(7-8-18(17)13-19)11-15-5-3-2-4-6-15/h2-10,12-13H,11,14H2,1H3
InChIKeyITRUKCYFSMQHDT-UHFFFAOYSA-N
XLogP4.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-bromo-4-[[4-(methoxymethoxy)phenyl]methyl]-1-phenylmethoxybenzene
CID 59141082
2-benzylnaphthalene
CID 11948
(6-benzylnaphthalen-2-yl) acetate
CID 132602814
1-benzyl-4-methoxybenzene;molecular nitrogen
CID 175140604
2-[(3-benzylphenyl)methyl]naphthalene
CID 157208363
2-bromo-6-(methoxymethoxy)naphthalene
CID 14499197
2-[2-(3-benzylphenoxy)ethyl]naphthalene
CID 141063921
2-(naphthalen-2-ylmethyl)naphthalene
CID 14123480
benzylbenzene;methoxymethane
CID 161110966
1,4-bis(methoxymethoxy)benzene
CID 542643
1-benzyl-4-methoxybenzene;hexafluoroantimony(1-);hydron
CID 158050824
1-(methoxymethoxy)-3-(methoxymethyl)benzene
CID 138736318

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-6-(methoxymethoxy)naphthalene?
The IUPAC name of 2-benzyl-6-(methoxymethoxy)naphthalene (CID 132602813) is 2-benzyl-6-(methoxymethoxy)naphthalene.
What is the SMILES notation for 2-benzyl-6-(methoxymethoxy)naphthalene?
The canonical SMILES for 2-benzyl-6-(methoxymethoxy)naphthalene is COCOc1ccc2cc(Cc3ccccc3)ccc2c1.
What is the InChIKey of 2-benzyl-6-(methoxymethoxy)naphthalene?
The InChIKey is ITRUKCYFSMQHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O2/c1-20-14-21-19-10-9-17-12-16(7-8-18(17)13-19)11-15-5-3-2-4-6-15/h2-10,12-13H,11,14H2,1H3.
What are the key properties of 2-benzyl-6-(methoxymethoxy)naphthalene?
2-benzyl-6-(methoxymethoxy)naphthalene has a molecular weight of 278.35 g/mol, XLogP of 4.41, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-6-(methoxymethoxy)naphthalene is sourced from PubChem (CID 132602813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).