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

C19H15N3 — CID 695136

IUPAC2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile
SMILESCc1ccc(-c2cc(-c3ccccc3)nc(N)c2C#N)cc1
InChIInChI=1S/C19H15N3/c1-13-7-9-14(10-8-13)16-11-18(15-5-3-2-4-6-15)22-19(21)17(16)12-20/h2-11H,1H3,(H2,21,22)
InChIKeyADSZRHDJWBZORK-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.18
Rot. Bonds2

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

2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile (PubChem CID 695136) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile
PubChem CID695136
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile
SMILESCc1ccc(-c2cc(-c3ccccc3)nc(N)c2C#N)cc1
InChIInChI=1S/C19H15N3/c1-13-7-9-14(10-8-13)16-11-18(15-5-3-2-4-6-15)22-19(21)17(16)12-20/h2-11H,1H3,(H2,21,22)
InChIKeyADSZRHDJWBZORK-UHFFFAOYSA-N
XLogP4.18
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile (CID 695136) is 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile is Cc1ccc(-c2cc(-c3ccccc3)nc(N)c2C#N)cc1.
What is the InChIKey of 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile?
The InChIKey is ADSZRHDJWBZORK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-13-7-9-14(10-8-13)16-11-18(15-5-3-2-4-6-15)22-19(21)17(16)12-20/h2-11H,1H3,(H2,21,22).
What are the key properties of 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile?
2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile has a molecular weight of 285.35 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 695136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).