4-fluoro-2,6-dipyridin-3-ylaniline

C16H12FN3 — CID 46316799

IUPAC4-fluoro-2,6-dipyridin-3-ylaniline
SMILESNc1c(-c2cccnc2)cc(F)cc1-c1cccnc1
InChIInChI=1S/C16H12FN3/c17-13-7-14(11-3-1-5-19-9-11)16(18)15(8-13)12-4-2-6-20-10-12/h1-10H,18H2
InChIKeyNLXPHHIEVHIASN-UHFFFAOYSA-N
MW265.29 g/mol
LogP3.53
Rot. Bonds2

About 4-fluoro-2,6-dipyridin-3-ylaniline

4-fluoro-2,6-dipyridin-3-ylaniline (PubChem CID 46316799) has the molecular formula C16H12FN3 and a molecular weight of 265.29 g/mol. Its IUPAC name is 4-fluoro-2,6-dipyridin-3-ylaniline.

Molecular Properties

Compound Name4-fluoro-2,6-dipyridin-3-ylaniline
PubChem CID46316799
Molecular FormulaC16H12FN3
Molecular Weight265.29 g/mol
Exact Mass265.10
IUPAC Name4-fluoro-2,6-dipyridin-3-ylaniline
SMILESNc1c(-c2cccnc2)cc(F)cc1-c1cccnc1
InChIInChI=1S/C16H12FN3/c17-13-7-14(11-3-1-5-19-9-11)16(18)15(8-13)12-4-2-6-20-10-12/h1-10H,18H2
InChIKeyNLXPHHIEVHIASN-UHFFFAOYSA-N
XLogP3.53
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-fluoro-2,6-dipyridin-3-ylaniline 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

3-(5-fluoro-2-iodo-3-pyridin-3-ylphenyl)pyridine
CID 46316519
5-fluoro-2,3-dipyridin-3-ylpyridine
CID 46316529
3-(5-fluoro-2-isocyanato-3-propan-2-ylphenyl)pyridine;4-fluoro-2-propan-2-yl-6-pyridin-3-ylaniline
CID 161419774
4-fluoro-2-pyridin-3-ylbenzonitrile
CID 46315558
2,4-dipyridin-3-ylaniline
CID 46316358
3-[4-fluoro-2-(trifluoromethyl)phenyl]pyridine
CID 46317075
3-(4-fluoro-5-methyl-2-pyridin-3-ylphenyl)pyridine
CID 46316767
3-fluoro-4-pyridin-3-ylphenol
CID 46315770
3-(2-fluoro-4-iodo-5-pyridin-3-ylphenyl)pyridine
CID 46316515
3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
CID 155748097
(3-amino-1-oxido-2-pyridin-3-ylpyridin-1-ium-4-yl)-(2,4-difluorophenyl)methanone
CID 24744185
3-(2,5-difluoro-4-methylphenyl)pyridine
CID 143759776

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2,6-dipyridin-3-ylaniline?
The IUPAC name of 4-fluoro-2,6-dipyridin-3-ylaniline (CID 46316799) is 4-fluoro-2,6-dipyridin-3-ylaniline.
What is the SMILES notation for 4-fluoro-2,6-dipyridin-3-ylaniline?
The canonical SMILES for 4-fluoro-2,6-dipyridin-3-ylaniline is Nc1c(-c2cccnc2)cc(F)cc1-c1cccnc1.
What is the InChIKey of 4-fluoro-2,6-dipyridin-3-ylaniline?
The InChIKey is NLXPHHIEVHIASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN3/c17-13-7-14(11-3-1-5-19-9-11)16(18)15(8-13)12-4-2-6-20-10-12/h1-10H,18H2.
What are the key properties of 4-fluoro-2,6-dipyridin-3-ylaniline?
4-fluoro-2,6-dipyridin-3-ylaniline has a molecular weight of 265.29 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2,6-dipyridin-3-ylaniline is sourced from PubChem (CID 46316799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).