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

C18H12FN3 — CID 917384

IUPAC2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1N
InChIInChI=1S/C18H12FN3/c19-14-8-6-12(7-9-14)15-10-17(13-4-2-1-3-5-13)22-18(21)16(15)11-20/h1-10H,(H2,21,22)
InChIKeyBEDLZHWQNOIFFN-UHFFFAOYSA-N
MW289.31 g/mol
LogP4.01
Rot. Bonds2

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

2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile (PubChem CID 917384) has the molecular formula C18H12FN3 and a molecular weight of 289.31 g/mol. Its IUPAC name is 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
PubChem CID917384
Molecular FormulaC18H12FN3
Molecular Weight289.31 g/mol
Exact Mass289.10
IUPAC Name2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1N
InChIInChI=1S/C18H12FN3/c19-14-8-6-12(7-9-14)15-10-17(13-4-2-1-3-5-13)22-18(21)16(15)11-20/h1-10H,(H2,21,22)
InChIKeyBEDLZHWQNOIFFN-UHFFFAOYSA-N
XLogP4.01
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 54.01
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-fluorophenyl)-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile (CID 917384) is 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile is N#Cc1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1N.
What is the InChIKey of 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile?
The InChIKey is BEDLZHWQNOIFFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3/c19-14-8-6-12(7-9-14)15-10-17(13-4-2-1-3-5-13)22-18(21)16(15)11-20/h1-10H,(H2,21,22).
What are the key properties of 2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile?
2-amino-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile has a molecular weight of 289.31 g/mol, XLogP of 4.01, 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-fluorophenyl)-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 917384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).