2-methyl-6-naphthalen-1-ylquinoline

C20H15N — CID 58099181

IUPAC2-methyl-6-naphthalen-1-ylquinoline
SMILESCc1ccc2cc(-c3cccc4ccccc34)ccc2n1
InChIInChI=1S/C20H15N/c1-14-9-10-17-13-16(11-12-20(17)21-14)19-8-4-6-15-5-2-3-7-18(15)19/h2-13H,1H3
InChIKeyFJTZBFNZWKJFOV-UHFFFAOYSA-N
MW269.35 g/mol
LogP5.36
Rot. Bonds1

About 2-methyl-6-naphthalen-1-ylquinoline

2-methyl-6-naphthalen-1-ylquinoline (PubChem CID 58099181) has the molecular formula C20H15N and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-methyl-6-naphthalen-1-ylquinoline.

Molecular Properties

Compound Name2-methyl-6-naphthalen-1-ylquinoline
PubChem CID58099181
Molecular FormulaC20H15N
Molecular Weight269.35 g/mol
Exact Mass269.12
IUPAC Name2-methyl-6-naphthalen-1-ylquinoline
SMILESCc1ccc2cc(-c3cccc4ccccc34)ccc2n1
InChIInChI=1S/C20H15N/c1-14-9-10-17-13-16(11-12-20(17)21-14)19-8-4-6-15-5-2-3-7-18(15)19/h2-13H,1H3
InChIKeyFJTZBFNZWKJFOV-UHFFFAOYSA-N
XLogP5.36
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.35
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-naphthalen-1-ylquinoline?
The IUPAC name of 2-methyl-6-naphthalen-1-ylquinoline (CID 58099181) is 2-methyl-6-naphthalen-1-ylquinoline.
What is the SMILES notation for 2-methyl-6-naphthalen-1-ylquinoline?
The canonical SMILES for 2-methyl-6-naphthalen-1-ylquinoline is Cc1ccc2cc(-c3cccc4ccccc34)ccc2n1.
What is the InChIKey of 2-methyl-6-naphthalen-1-ylquinoline?
The InChIKey is FJTZBFNZWKJFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N/c1-14-9-10-17-13-16(11-12-20(17)21-14)19-8-4-6-15-5-2-3-7-18(15)19/h2-13H,1H3.
What are the key properties of 2-methyl-6-naphthalen-1-ylquinoline?
2-methyl-6-naphthalen-1-ylquinoline has a molecular weight of 269.35 g/mol, XLogP of 5.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-naphthalen-1-ylquinoline is sourced from PubChem (CID 58099181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).