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

C18H13N3O — CID 791050

IUPAC2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccc(O)cc2)nc1N
InChIInChI=1S/C18H13N3O/c19-11-16-15(12-4-2-1-3-5-12)10-17(21-18(16)20)13-6-8-14(22)9-7-13/h1-10,22H,(H2,20,21)
InChIKeyVVFRJCXNTHXSOG-UHFFFAOYSA-N
MW287.32 g/mol
LogP3.58
Rot. Bonds2

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

2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile (PubChem CID 791050) has the molecular formula C18H13N3O and a molecular weight of 287.32 g/mol. Its IUPAC name is 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile
PubChem CID791050
Molecular FormulaC18H13N3O
Molecular Weight287.32 g/mol
Exact Mass287.11
IUPAC Name2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccc(O)cc2)nc1N
InChIInChI=1S/C18H13N3O/c19-11-16-15(12-4-2-1-3-5-12)10-17(21-18(16)20)13-6-8-14(22)9-7-13/h1-10,22H,(H2,20,21)
InChIKeyVVFRJCXNTHXSOG-UHFFFAOYSA-N
XLogP3.58
TPSA82.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile (CID 791050) is 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile is N#Cc1c(-c2ccccc2)cc(-c2ccc(O)cc2)nc1N.
What is the InChIKey of 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile?
The InChIKey is VVFRJCXNTHXSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O/c19-11-16-15(12-4-2-1-3-5-12)10-17(21-18(16)20)13-6-8-14(22)9-7-13/h1-10,22H,(H2,20,21).
What are the key properties of 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile?
2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile has a molecular weight of 287.32 g/mol, XLogP of 3.58, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 791050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).