2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene

C23H20O — CID 3646227

IUPAC2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene
SMILESCOCC(c1ccc2ccccc2c1)c1ccc2ccccc2c1
InChIInChI=1S/C23H20O/c1-24-16-23(21-12-10-17-6-2-4-8-19(17)14-21)22-13-11-18-7-3-5-9-20(18)15-22/h2-15,23H,16H2,1H3
InChIKeyGVXGCHSMWODUTG-UHFFFAOYSA-N
MW312.41 g/mol
LogP5.77
Rot. Bonds4

About 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene

2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene (PubChem CID 3646227) has the molecular formula C23H20O and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene.

Molecular Properties

Compound Name2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene
PubChem CID3646227
Molecular FormulaC23H20O
Molecular Weight312.41 g/mol
Exact Mass312.15
IUPAC Name2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene
SMILESCOCC(c1ccc2ccccc2c1)c1ccc2ccccc2c1
InChIInChI=1S/C23H20O/c1-24-16-23(21-12-10-17-6-2-4-8-19(17)14-21)22-13-11-18-7-3-5-9-20(18)15-22/h2-15,23H,16H2,1H3
InChIKeyGVXGCHSMWODUTG-UHFFFAOYSA-N
XLogP5.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methoxy-N-(1-naphthalen-2-ylethyl)propan-2-amine
CID 43191837
(3-methoxy-1-naphthalen-2-ylpropyl)hydrazine
CID 105206319
ethane;2-propan-2-ylnaphthalene
CID 142226111
2-(2-methoxyethylamino)-1-naphthalen-2-ylethanol
CID 60903871
4-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]-1-methoxybutan-2-ol
CID 106246545
2-(2-methoxyethoxyamino)-1-naphthalen-2-ylethanol
CID 82723004
2-propan-2-ylpentacene
CID 153380535
2-(1-butoxypropan-2-yl)naphthalene
CID 91801948
cumene;ethane;methane;2-propan-2-ylnaphthalene
CID 158431045
1-methoxy-3-naphthalen-2-ylpropan-2-ol
CID 105112115
3-methoxy-3-naphthalen-2-ylpropan-1-ol
CID 101246159
2-[1-(4-methylphenyl)-2-phenylethyl]naphthalene
CID 19077007

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene?
The IUPAC name of 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene (CID 3646227) is 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene.
What is the SMILES notation for 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene?
The canonical SMILES for 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene is COCC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.
What is the InChIKey of 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene?
The InChIKey is GVXGCHSMWODUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O/c1-24-16-23(21-12-10-17-6-2-4-8-19(17)14-21)22-13-11-18-7-3-5-9-20(18)15-22/h2-15,23H,16H2,1H3.
What are the key properties of 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene?
2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene has a molecular weight of 312.41 g/mol, XLogP of 5.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene is sourced from PubChem (CID 3646227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).