2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile

C23H16N2O — CID 14066095

IUPAC2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile
SMILESCOc1nc(-c2ccccc2)cc(-c2cccc3ccccc23)c1C#N
InChIInChI=1S/C23H16N2O/c1-26-23-21(15-24)20(14-22(25-23)17-9-3-2-4-10-17)19-13-7-11-16-8-5-6-12-18(16)19/h2-14H,1H3
InChIKeyRVAPQYRRLVFVSN-UHFFFAOYSA-N
MW336.39 g/mol
LogP5.45
Rot. Bonds3

About 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile

2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile (PubChem CID 14066095) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile
PubChem CID14066095
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Name2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile
SMILESCOc1nc(-c2ccccc2)cc(-c2cccc3ccccc23)c1C#N
InChIInChI=1S/C23H16N2O/c1-26-23-21(15-24)20(14-22(25-23)17-9-3-2-4-10-17)19-13-7-11-16-8-5-6-12-18(16)19/h2-14H,1H3
InChIKeyRVAPQYRRLVFVSN-UHFFFAOYSA-N
XLogP5.45
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-hydroxyphenyl)-2-methoxy-6-phenylpyridine-3-carbonitrile
CID 135692578
6-azulen-1-yl-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 10641600
N-[4-(5-cyano-6-methoxy-4-phenyl-2-pyridinyl)phenyl]acetamide
CID 70924863
methyl 3-[3-cyano-2-methoxy-6-(4-methoxyphenyl)-4-pyridinyl]azulene-1-carboxylate
CID 10693609
4-naphthalen-1-yl-2,6-diphenylpyrimidine
CID 71273252
2-amino-4-(2-methoxyphenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5231002
3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl]propanoic acid
CID 53270216
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130260993
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile
CID 169296947
4,6-bis(4-methoxyphenyl)-2-phenylpyridine-3-carbonitrile
CID 12575125
2-amino-6-phenyl-4-(2,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 3353886
6-(4-bromophenyl)-2-ethoxy-4-phenylpyridine-3-carbonitrile
CID 3112245

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile (CID 14066095) is 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile is COc1nc(-c2ccccc2)cc(-c2cccc3ccccc23)c1C#N.
What is the InChIKey of 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile?
The InChIKey is RVAPQYRRLVFVSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c1-26-23-21(15-24)20(14-22(25-23)17-9-3-2-4-10-17)19-13-7-11-16-8-5-6-12-18(16)19/h2-14H,1H3.
What are the key properties of 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile?
2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile has a molecular weight of 336.39 g/mol, XLogP of 5.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 14066095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).