2-(3-methylanthracen-1-yl)pyridine

C20H15N — CID 169060480

IUPAC2-(3-methylanthracen-1-yl)pyridine
SMILESCc1cc(-c2ccccn2)c2cc3ccccc3cc2c1
InChIInChI=1S/C20H15N/c1-14-10-17-12-15-6-2-3-7-16(15)13-18(17)19(11-14)20-8-4-5-9-21-20/h2-13H,1H3
InChIKeyZVXJCOSFJXYSIT-UHFFFAOYSA-N
MW269.35 g/mol
LogP5.36
Rot. Bonds1

About 2-(3-methylanthracen-1-yl)pyridine

2-(3-methylanthracen-1-yl)pyridine (PubChem CID 169060480) has the molecular formula C20H15N and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-(3-methylanthracen-1-yl)pyridine.

Molecular Properties

Compound Name2-(3-methylanthracen-1-yl)pyridine
PubChem CID169060480
Molecular FormulaC20H15N
Molecular Weight269.35 g/mol
Exact Mass269.12
IUPAC Name2-(3-methylanthracen-1-yl)pyridine
SMILESCc1cc(-c2ccccn2)c2cc3ccccc3cc2c1
InChIInChI=1S/C20H15N/c1-14-10-17-12-15-6-2-3-7-16(15)13-18(17)19(11-14)20-8-4-5-9-21-20/h2-13H,1H3
InChIKeyZVXJCOSFJXYSIT-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-(1-pyridin-2-ylanthracen-2-yl)pyridine
CID 19367617
2-(2-iodo-5-methyl-3-pyridin-2-ylphenyl)pyridine
CID 101459024
2-[3-[1-(2-hydroxy-5-methyl-3-pyridin-2-ylphenyl)isoquinolin-3-yl]isoquinolin-1-yl]-4-methyl-6-pyridin-2-ylphenol
CID 135961658
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
2-[4-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]naphthalen-1-yl]pyridine
CID 88552190
5-anthracen-1-yl-2-pyridin-2-ylpyridine
CID 58813785
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677
2-[3-methyl-5-(3-naphthalen-1-ylanthracen-9-yl)phenyl]pyridine
CID 141483257
2-[3-[3-(3,5-dipyridin-2-ylphenyl)-5-methylphenyl]-5-pyridin-2-ylphenyl]pyridine
CID 58556429
2-(2,6-dimethyldibenzofuran-4-yl)pyridine
CID 156686870
2-(2,4-dimethylphenyl)pyridine;ethane
CID 143636710
2-(25-pyridin-2-yl-7-decacyclo[27.7.1.111,15.02,28.04,26.05,23.08,22.010,20.033,37.019,38]octatriaconta-1(36),2,4,6,8(22),9,11,13,15(38),16,18,20,23,25,27,29,31,33(37),34-nonadecaenyl)pyridine
CID 58471026

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylanthracen-1-yl)pyridine?
The IUPAC name of 2-(3-methylanthracen-1-yl)pyridine (CID 169060480) is 2-(3-methylanthracen-1-yl)pyridine.
What is the SMILES notation for 2-(3-methylanthracen-1-yl)pyridine?
The canonical SMILES for 2-(3-methylanthracen-1-yl)pyridine is Cc1cc(-c2ccccn2)c2cc3ccccc3cc2c1.
What is the InChIKey of 2-(3-methylanthracen-1-yl)pyridine?
The InChIKey is ZVXJCOSFJXYSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N/c1-14-10-17-12-15-6-2-3-7-16(15)13-18(17)19(11-14)20-8-4-5-9-21-20/h2-13H,1H3.
What are the key properties of 2-(3-methylanthracen-1-yl)pyridine?
2-(3-methylanthracen-1-yl)pyridine 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-(3-methylanthracen-1-yl)pyridine is sourced from PubChem (CID 169060480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).