2-ethyl-3-(2-methylphenyl)naphthalene

C19H18 — CID 148544062

IUPAC2-ethyl-3-(2-methylphenyl)naphthalene
SMILESCCc1cc2ccccc2cc1-c1ccccc1C
InChIInChI=1S/C19H18/c1-3-15-12-16-9-5-6-10-17(16)13-19(15)18-11-7-4-8-14(18)2/h4-13H,3H2,1-2H3
InChIKeyMSTGJJYAJJWJRF-UHFFFAOYSA-N
MW246.35 g/mol
LogP5.38
Rot. Bonds2

About 2-ethyl-3-(2-methylphenyl)naphthalene

2-ethyl-3-(2-methylphenyl)naphthalene (PubChem CID 148544062) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-ethyl-3-(2-methylphenyl)naphthalene.

Molecular Properties

Compound Name2-ethyl-3-(2-methylphenyl)naphthalene
PubChem CID148544062
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name2-ethyl-3-(2-methylphenyl)naphthalene
SMILESCCc1cc2ccccc2cc1-c1ccccc1C
InChIInChI=1S/C19H18/c1-3-15-12-16-9-5-6-10-17(16)13-19(15)18-11-7-4-8-14(18)2/h4-13H,3H2,1-2H3
InChIKeyMSTGJJYAJJWJRF-UHFFFAOYSA-N
XLogP5.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.35
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(2-methylphenyl)naphthalene?
The IUPAC name of 2-ethyl-3-(2-methylphenyl)naphthalene (CID 148544062) is 2-ethyl-3-(2-methylphenyl)naphthalene.
What is the SMILES notation for 2-ethyl-3-(2-methylphenyl)naphthalene?
The canonical SMILES for 2-ethyl-3-(2-methylphenyl)naphthalene is CCc1cc2ccccc2cc1-c1ccccc1C.
What is the InChIKey of 2-ethyl-3-(2-methylphenyl)naphthalene?
The InChIKey is MSTGJJYAJJWJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-3-15-12-16-9-5-6-10-17(16)13-19(15)18-11-7-4-8-14(18)2/h4-13H,3H2,1-2H3.
What are the key properties of 2-ethyl-3-(2-methylphenyl)naphthalene?
2-ethyl-3-(2-methylphenyl)naphthalene has a molecular weight of 246.35 g/mol, XLogP of 5.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(2-methylphenyl)naphthalene is sourced from PubChem (CID 148544062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).