ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline

C34H29N — CID 142621816

IUPACethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline
SMILESCC.Cc1cccc(-c2cc3ncccc3cc2-c2ccc(-c3cccc4ccccc34)cc2)c1
InChIInChI=1S/C32H23N.C2H6/c1-22-7-4-10-26(19-22)31-21-32-27(11-6-18-33-32)20-30(31)25-16-14-24(15-17-25)29-13-5-9-23-8-2-3-12-28(23)29;1-2/h2-21H,1H3;1-2H3
InChIKeyJRTKSNNNOWBIPK-UHFFFAOYSA-N
MW451.61 g/mol
LogP9.72
Rot. Bonds3

About ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline

ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline (PubChem CID 142621816) has the molecular formula C34H29N and a molecular weight of 451.61 g/mol. Its IUPAC name is ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline.

Molecular Properties

Compound Nameethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline
PubChem CID142621816
Molecular FormulaC34H29N
Molecular Weight451.61 g/mol
Exact Mass451.23
IUPAC Nameethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline
SMILESCC.Cc1cccc(-c2cc3ncccc3cc2-c2ccc(-c3cccc4ccccc34)cc2)c1
InChIInChI=1S/C32H23N.C2H6/c1-22-7-4-10-26(19-22)31-21-32-27(11-6-18-33-32)20-30(31)25-16-14-24(15-17-25)29-13-5-9-23-8-2-3-12-28(23)29;1-2/h2-21H,1H3;1-2H3
InChIKeyJRTKSNNNOWBIPK-UHFFFAOYSA-N
XLogP9.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.61
LogP ≤ 59.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[4-(3-methylphenyl)phenyl]quinoline
CID 121316110
6-(3-methylphenyl)quinoline
CID 4185278
1-(3-methylphenyl)naphthalene;2-(3-methylphenyl)naphthalene;2-[3-[3-(3-methylphenyl)phenyl]phenyl]naphthalene
CID 158274717
4-(3-methylphenyl)quinoline
CID 146587179
8-[2-(3-methylphenyl)phenyl]quinoline
CID 134445651
6-[6-(9,10-dinaphthalen-1-ylanthracen-2-yl)naphthalen-2-yl]benzo[f]quinoline
CID 58323733
6-[3-[6-(3-quinolin-6-ylphenyl)phenanthren-1-yl]phenyl]quinoline
CID 121287344
9-naphthalen-1-yl-10-[3-[3-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]naphthalen-2-yl]phenyl]anthracene
CID 168786911
6-[2-(3-methylphenyl)-3-pyridinyl]quinoxaline
CID 90095667
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 122416200
ethane;9-[4-(3-methylphenyl)naphthalen-1-yl]-10-naphthalen-2-ylanthracene
CID 157325912
1-(3-methyl-5-naphthalen-1-ylphenyl)naphthalene
CID 59171646

Frequently Asked Questions

What is the IUPAC name of ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline?
The IUPAC name of ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline (CID 142621816) is ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline.
What is the SMILES notation for ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline?
The canonical SMILES for ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline is CC.Cc1cccc(-c2cc3ncccc3cc2-c2ccc(-c3cccc4ccccc34)cc2)c1.
What is the InChIKey of ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline?
The InChIKey is JRTKSNNNOWBIPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23N.C2H6/c1-22-7-4-10-26(19-22)31-21-32-27(11-6-18-33-32)20-30(31)25-16-14-24(15-17-25)29-13-5-9-23-8-2-3-12-28(23)29;1-2/h2-21H,1H3;1-2H3.
What are the key properties of ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline?
ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline has a molecular weight of 451.61 g/mol, XLogP of 9.72, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-(3-methylphenyl)-6-(4-naphthalen-1-ylphenyl)quinoline is sourced from PubChem (CID 142621816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).