2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile

C19H14BrN3 — CID 3395709

IUPAC2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile
SMILESCc1cccc(-c2cc(-c3ccc(Br)cc3)nc(N)c2C#N)c1
InChIInChI=1S/C19H14BrN3/c1-12-3-2-4-14(9-12)16-10-18(23-19(22)17(16)11-21)13-5-7-15(20)8-6-13/h2-10H,1H3,(H2,22,23)
InChIKeyLBWOPCUNTIYAMW-UHFFFAOYSA-N
MW364.25 g/mol
LogP4.94
Rot. Bonds2

About 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile

2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile (PubChem CID 3395709) has the molecular formula C19H14BrN3 and a molecular weight of 364.25 g/mol. Its IUPAC name is 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile
PubChem CID3395709
Molecular FormulaC19H14BrN3
Molecular Weight364.25 g/mol
Exact Mass363.04
IUPAC Name2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile
SMILESCc1cccc(-c2cc(-c3ccc(Br)cc3)nc(N)c2C#N)c1
InChIInChI=1S/C19H14BrN3/c1-12-3-2-4-14(9-12)16-10-18(23-19(22)17(16)11-21)13-5-7-15(20)8-6-13/h2-10H,1H3,(H2,22,23)
InChIKeyLBWOPCUNTIYAMW-UHFFFAOYSA-N
XLogP4.94
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.25
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile (CID 3395709) is 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile is Cc1cccc(-c2cc(-c3ccc(Br)cc3)nc(N)c2C#N)c1.
What is the InChIKey of 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile?
The InChIKey is LBWOPCUNTIYAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrN3/c1-12-3-2-4-14(9-12)16-10-18(23-19(22)17(16)11-21)13-5-7-15(20)8-6-13/h2-10H,1H3,(H2,22,23).
What are the key properties of 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile?
2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile has a molecular weight of 364.25 g/mol, XLogP of 4.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 3395709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).