2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile

C18H11Cl2N3 — CID 3751417

IUPAC2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(Cl)cc2)cc(-c2ccccc2Cl)nc1N
InChIInChI=1S/C18H11Cl2N3/c19-12-7-5-11(6-8-12)14-9-17(23-18(22)15(14)10-21)13-3-1-2-4-16(13)20/h1-9H,(H2,22,23)
InChIKeyPPNTZGRFYNKJDB-UHFFFAOYSA-N
MW340.21 g/mol
LogP5.18
Rot. Bonds2

About 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile

2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile (PubChem CID 3751417) has the molecular formula C18H11Cl2N3 and a molecular weight of 340.21 g/mol. Its IUPAC name is 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile
PubChem CID3751417
Molecular FormulaC18H11Cl2N3
Molecular Weight340.21 g/mol
Exact Mass339.03
IUPAC Name2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(Cl)cc2)cc(-c2ccccc2Cl)nc1N
InChIInChI=1S/C18H11Cl2N3/c19-12-7-5-11(6-8-12)14-9-17(23-18(22)15(14)10-21)13-3-1-2-4-16(13)20/h1-9H,(H2,22,23)
InChIKeyPPNTZGRFYNKJDB-UHFFFAOYSA-N
XLogP5.18
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.21
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile (CID 3751417) is 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile is N#Cc1c(-c2ccc(Cl)cc2)cc(-c2ccccc2Cl)nc1N.
What is the InChIKey of 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile?
The InChIKey is PPNTZGRFYNKJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Cl2N3/c19-12-7-5-11(6-8-12)14-9-17(23-18(22)15(14)10-21)13-3-1-2-4-16(13)20/h1-9H,(H2,22,23).
What are the key properties of 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile?
2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile has a molecular weight of 340.21 g/mol, XLogP of 5.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(2-chlorophenyl)-4-(4-chlorophenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 3751417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).