2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile

C19H15N3O — CID 915425

IUPAC2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile
SMILESCOc1ccc(-c2cc(-c3ccccc3)c(C#N)c(N)n2)cc1
InChIInChI=1S/C19H15N3O/c1-23-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(21)22-18/h2-11H,1H3,(H2,21,22)
InChIKeyDDIVVCFYDLQKQB-UHFFFAOYSA-N
MW301.35 g/mol
LogP3.88
Rot. Bonds3

About 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile

2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile (PubChem CID 915425) has the molecular formula C19H15N3O and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile
PubChem CID915425
Molecular FormulaC19H15N3O
Molecular Weight301.35 g/mol
Exact Mass301.12
IUPAC Name2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile
SMILESCOc1ccc(-c2cc(-c3ccccc3)c(C#N)c(N)n2)cc1
InChIInChI=1S/C19H15N3O/c1-23-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(21)22-18/h2-11H,1H3,(H2,21,22)
InChIKeyDDIVVCFYDLQKQB-UHFFFAOYSA-N
XLogP3.88
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile (CID 915425) is 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile is COc1ccc(-c2cc(-c3ccccc3)c(C#N)c(N)n2)cc1.
What is the InChIKey of 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile?
The InChIKey is DDIVVCFYDLQKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O/c1-23-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(21)22-18/h2-11H,1H3,(H2,21,22).
What are the key properties of 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile?
2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile has a molecular weight of 301.35 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 915425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).