3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine

C11H7Cl2F2N3 — CID 114046291

IUPAC3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine
SMILESNc1cnc(Nc2c(F)cc(F)cc2Cl)c(Cl)c1
InChIInChI=1S/C11H7Cl2F2N3/c12-7-1-5(14)2-9(15)10(7)18-11-8(13)3-6(16)4-17-11/h1-4H,16H2,(H,17,18)
InChIKeyLFSJYOYQEUXTQA-UHFFFAOYSA-N
MW290.10 g/mol
LogP3.99
Rot. Bonds2

About 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine

3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine (PubChem CID 114046291) has the molecular formula C11H7Cl2F2N3 and a molecular weight of 290.10 g/mol. Its IUPAC name is 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine
PubChem CID114046291
Molecular FormulaC11H7Cl2F2N3
Molecular Weight290.10 g/mol
Exact Mass289.00
IUPAC Name3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine
SMILESNc1cnc(Nc2c(F)cc(F)cc2Cl)c(Cl)c1
InChIInChI=1S/C11H7Cl2F2N3/c12-7-1-5(14)2-9(15)10(7)18-11-8(13)3-6(16)4-17-11/h1-4H,16H2,(H,17,18)
InChIKeyLFSJYOYQEUXTQA-UHFFFAOYSA-N
XLogP3.99
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.10
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine
CID 102987080
3-bromo-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridin-2-amine
CID 114837355
3-chloro-2-N-(2,6-dichlorophenyl)pyridine-2,5-diamine
CID 114046251
5-amino-6-(2-chloro-4,6-difluoroanilino)pyridine-3-carboxylic acid
CID 83087906
2-chloro-N-(2-chloro-4,6-difluorophenyl)-5-fluoropyrimidin-4-amine
CID 83087621
2-N-(3-bromo-4-fluorophenyl)-3-chloropyridine-2,5-diamine
CID 114046311
4-N-(2-chloro-4,6-difluorophenyl)-5-ethylpyrimidine-4,6-diamine
CID 83082644
N-(2-chloro-4,6-difluorophenyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 83082645
3-chloro-2-N-phenylpyridine-2,5-diamine
CID 82472496
5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridin-2-amine
CID 83088172
4,5-dichloro-2-N-(2-chloro-4,6-difluorophenyl)benzene-1,2-diamine
CID 83081059
3-(2-chloro-4,6-difluoroanilino)pyrazine-2-carbonitrile
CID 83087195

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine?
The IUPAC name of 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine (CID 114046291) is 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine.
What is the SMILES notation for 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine?
The canonical SMILES for 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine is Nc1cnc(Nc2c(F)cc(F)cc2Cl)c(Cl)c1.
What is the InChIKey of 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine?
The InChIKey is LFSJYOYQEUXTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2F2N3/c12-7-1-5(14)2-9(15)10(7)18-11-8(13)3-6(16)4-17-11/h1-4H,16H2,(H,17,18).
What are the key properties of 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine?
3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine has a molecular weight of 290.10 g/mol, XLogP of 3.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine is sourced from PubChem (CID 114046291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).