3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine

C11H8Cl2FN3 — CID 102755142

IUPAC3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine
SMILESNc1nc(Nc2ccc(F)cc2)c(Cl)cc1Cl
InChIInChI=1S/C11H8Cl2FN3/c12-8-5-9(13)11(17-10(8)15)16-7-3-1-6(14)2-4-7/h1-5H,(H3,15,16,17)
InChIKeyXUEGJQSRPVDFMO-UHFFFAOYSA-N
MW272.11 g/mol
LogP3.85
Rot. Bonds2

About 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine

3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine (PubChem CID 102755142) has the molecular formula C11H8Cl2FN3 and a molecular weight of 272.11 g/mol. Its IUPAC name is 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine
PubChem CID102755142
Molecular FormulaC11H8Cl2FN3
Molecular Weight272.11 g/mol
Exact Mass271.01
IUPAC Name3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine
SMILESNc1nc(Nc2ccc(F)cc2)c(Cl)cc1Cl
InChIInChI=1S/C11H8Cl2FN3/c12-8-5-9(13)11(17-10(8)15)16-7-3-1-6(14)2-4-7/h1-5H,(H3,15,16,17)
InChIKeyXUEGJQSRPVDFMO-UHFFFAOYSA-N
XLogP3.85
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.11
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-N-(3,4-difluorophenyl)pyridine-2,6-diamine
CID 102755062
3,5-dichloro-6-N-(2-chloro-4-fluorophenyl)pyridine-2,6-diamine
CID 102754342
6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine
CID 102755131
3,5-dichloro-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-diamine
CID 102756297
3,5-dichloro-6-N-(3-propan-2-ylphenyl)pyridine-2,6-diamine
CID 102754630
3,5-dichloro-N-(4-chlorophenyl)-6-hydrazinylpyridin-2-amine
CID 102762339
3,5-dichloro-6-N-[(3-fluorophenyl)methyl]pyridine-2,6-diamine
CID 102755761
4-N,6-N-bis(4-fluorophenyl)pyrimidine-4,5,6-triamine
CID 19148988
6-chloro-3-fluoro-N-(4-fluorophenyl)pyridin-2-amine
CID 90134132
4-N-(2-chloro-4-fluorophenyl)benzene-1,4-diamine
CID 29080218
5-chloro-4-N-(4-fluorophenyl)-2-N-methylpyrimidine-2,4-diamine
CID 80761316
4-N-(4-fluorophenyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80761015

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine (CID 102755142) is 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine is Nc1nc(Nc2ccc(F)cc2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine?
The InChIKey is XUEGJQSRPVDFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2FN3/c12-8-5-9(13)11(17-10(8)15)16-7-3-1-6(14)2-4-7/h1-5H,(H3,15,16,17).
What are the key properties of 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine?
3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine has a molecular weight of 272.11 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine is sourced from PubChem (CID 102755142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).