1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene

C19H18O3 — CID 161363992

IUPAC1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene
SMILESCOc1ccccc1-c1cc(OC)c2ccccc2c1OC
InChIInChI=1S/C19H18O3/c1-20-17-11-7-6-9-14(17)16-12-18(21-2)13-8-4-5-10-15(13)19(16)22-3/h4-12H,1-3H3
InChIKeyBFFJGKUSDLDJNA-UHFFFAOYSA-N
MW294.35 g/mol
LogP4.53
Rot. Bonds4

About 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene

1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene (PubChem CID 161363992) has the molecular formula C19H18O3 and a molecular weight of 294.35 g/mol. Its IUPAC name is 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene.

Molecular Properties

Compound Name1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene
PubChem CID161363992
Molecular FormulaC19H18O3
Molecular Weight294.35 g/mol
Exact Mass294.13
IUPAC Name1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene
SMILESCOc1ccccc1-c1cc(OC)c2ccccc2c1OC
InChIInChI=1S/C19H18O3/c1-20-17-11-7-6-9-14(17)16-12-18(21-2)13-8-4-5-10-15(13)19(16)22-3/h4-12H,1-3H3
InChIKeyBFFJGKUSDLDJNA-UHFFFAOYSA-N
XLogP4.53
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene?
The IUPAC name of 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene (CID 161363992) is 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene.
What is the SMILES notation for 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene?
The canonical SMILES for 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene is COc1ccccc1-c1cc(OC)c2ccccc2c1OC.
What is the InChIKey of 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene?
The InChIKey is BFFJGKUSDLDJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O3/c1-20-17-11-7-6-9-14(17)16-12-18(21-2)13-8-4-5-10-15(13)19(16)22-3/h4-12H,1-3H3.
What are the key properties of 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene?
1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene has a molecular weight of 294.35 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene is sourced from PubChem (CID 161363992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).