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

C18H11BrFN3 — CID 3394237

IUPAC2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccc(Br)cc2)nc1N
InChIInChI=1S/C18H11BrFN3/c19-13-5-1-12(2-6-13)17-9-15(16(10-21)18(22)23-17)11-3-7-14(20)8-4-11/h1-9H,(H2,22,23)
InChIKeyGTPZKWJUNITMQF-UHFFFAOYSA-N
MW368.21 g/mol
LogP4.77
Rot. Bonds2

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

2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile (PubChem CID 3394237) has the molecular formula C18H11BrFN3 and a molecular weight of 368.21 g/mol. Its IUPAC name is 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile
PubChem CID3394237
Molecular FormulaC18H11BrFN3
Molecular Weight368.21 g/mol
Exact Mass367.01
IUPAC Name2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccc(Br)cc2)nc1N
InChIInChI=1S/C18H11BrFN3/c19-13-5-1-12(2-6-13)17-9-15(16(10-21)18(22)23-17)11-3-7-14(20)8-4-11/h1-9H,(H2,22,23)
InChIKeyGTPZKWJUNITMQF-UHFFFAOYSA-N
XLogP4.77
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.21
LogP ≤ 54.77
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-(4-fluorophenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile (CID 3394237) is 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile is N#Cc1c(-c2ccc(F)cc2)cc(-c2ccc(Br)cc2)nc1N.
What is the InChIKey of 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile?
The InChIKey is GTPZKWJUNITMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11BrFN3/c19-13-5-1-12(2-6-13)17-9-15(16(10-21)18(22)23-17)11-3-7-14(20)8-4-11/h1-9H,(H2,22,23).
What are the key properties of 2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile?
2-amino-6-(4-bromophenyl)-4-(4-fluorophenyl)pyridine-3-carbonitrile has a molecular weight of 368.21 g/mol, XLogP of 4.77, 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-(4-fluorophenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 3394237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).