2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile

C19H14N2O2 — CID 1487474

IUPAC2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile
SMILESCOc1ccc(Oc2nccc(-c3ccccc3)c2C#N)cc1
InChIInChI=1S/C19H14N2O2/c1-22-15-7-9-16(10-8-15)23-19-18(13-20)17(11-12-21-19)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyWFCBYUPGMLGUDD-UHFFFAOYSA-N
MW302.33 g/mol
LogP4.42
Rot. Bonds4

About 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile

2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile (PubChem CID 1487474) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile
PubChem CID1487474
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile
SMILESCOc1ccc(Oc2nccc(-c3ccccc3)c2C#N)cc1
InChIInChI=1S/C19H14N2O2/c1-22-15-7-9-16(10-8-15)23-19-18(13-20)17(11-12-21-19)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyWFCBYUPGMLGUDD-UHFFFAOYSA-N
XLogP4.42
TPSA55.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile (CID 1487474) is 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile is COc1ccc(Oc2nccc(-c3ccccc3)c2C#N)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile?
The InChIKey is WFCBYUPGMLGUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c1-22-15-7-9-16(10-8-15)23-19-18(13-20)17(11-12-21-19)14-5-3-2-4-6-14/h2-12H,1H3.
What are the key properties of 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile?
2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile has a molecular weight of 302.33 g/mol, XLogP of 4.42, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-4-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 1487474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).