N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine

C19H12F2N6 — CID 146550074

IUPACN-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine
SMILESFc1cccc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)c1
InChIInChI=1S/C19H12F2N6/c20-13-4-1-5-14(9-13)24-19-25-17(12-3-2-7-22-10-12)18(26-27-19)15-6-8-23-11-16(15)21/h1-11H,(H,24,25,27)
InChIKeyUHAZPVKJBZMDQL-UHFFFAOYSA-N
MW362.34 g/mol
LogP4.02
Rot. Bonds4

About N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine

N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine (PubChem CID 146550074) has the molecular formula C19H12F2N6 and a molecular weight of 362.34 g/mol. Its IUPAC name is N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine
PubChem CID146550074
Molecular FormulaC19H12F2N6
Molecular Weight362.34 g/mol
Exact Mass362.11
IUPAC NameN-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine
SMILESFc1cccc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)c1
InChIInChI=1S/C19H12F2N6/c20-13-4-1-5-14(9-13)24-19-25-17(12-3-2-7-22-10-12)18(26-27-19)15-6-8-23-11-16(15)21/h1-11H,(H,24,25,27)
InChIKeyUHAZPVKJBZMDQL-UHFFFAOYSA-N
XLogP4.02
TPSA76.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.34
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-yl]-3-methyl-1,2,4-thiadiazol-5-amine
CID 146548815
3,4-bis(3-fluorophenyl)pyridine
CID 46313677
6-(3-fluoro-4-pyridinyl)-N-phenyl-5-pyridin-3-yl-1H-imidazo[4,5-b]pyridin-2-amine
CID 141174247
3-N-(3-fluorophenyl)-5-N-quinolin-8-yl-1,2,4-triazine-3,5-diamine
CID 112969109
5-(3,5-difluoro-4-pyridinyl)-6-pyridin-3-ylpyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-ylpyrazin-2-amine
CID 69149581
N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide
CID 164589782
N-[3-(1,1-difluoroethyl)phenyl]-5-fluoro-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 162549510
5-N-(3-fluorophenyl)-3-N-quinolin-8-yl-1,2,4-triazine-3,5-diamine
CID 112969076
5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-3-[(2S)-1,1,1-trifluoropropan-2-yl]pyrazin-2-amine
CID 91242587
3-(3-fluorophenyl)-N-(3-pyridin-3-ylphenyl)triazolo[4,5-d]pyrimidin-5-amine
CID 58691451
5-N-(4-chloro-2-methylphenyl)-3-N-(3-fluorophenyl)-1,2,4-triazine-3,5-diamine
CID 112966410
N-(3-fluorophenyl)-2H-tetrazol-5-amine
CID 130013830

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine?
The IUPAC name of N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine (CID 146550074) is N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine.
What is the SMILES notation for N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine?
The canonical SMILES for N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine is Fc1cccc(Nc2nnc(-c3ccncc3F)c(-c3cccnc3)n2)c1.
What is the InChIKey of N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine?
The InChIKey is UHAZPVKJBZMDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N6/c20-13-4-1-5-14(9-13)24-19-25-17(12-3-2-7-22-10-12)18(26-27-19)15-6-8-23-11-16(15)21/h1-11H,(H,24,25,27).
What are the key properties of N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine?
N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine has a molecular weight of 362.34 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-6-(3-fluoro-4-pyridinyl)-5-pyridin-3-yl-1,2,4-triazin-3-amine is sourced from PubChem (CID 146550074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).