6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine

C11H9ClFN3 — CID 80653049

IUPAC6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc(Cl)cc2F)n1
InChIInChI=1S/C11H9ClFN3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16)
InChIKeyHINHCJQIJWDHCC-UHFFFAOYSA-N
MW237.67 g/mol
LogP3.20
Rot. Bonds2

About 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine

6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine (PubChem CID 80653049) has the molecular formula C11H9ClFN3 and a molecular weight of 237.67 g/mol. Its IUPAC name is 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine
PubChem CID80653049
Molecular FormulaC11H9ClFN3
Molecular Weight237.67 g/mol
Exact Mass237.05
IUPAC Name6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc(Cl)cc2F)n1
InChIInChI=1S/C11H9ClFN3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16)
InChIKeyHINHCJQIJWDHCC-UHFFFAOYSA-N
XLogP3.20
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.67
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(2,4-difluorophenyl)pyridine-2,6-diamine
CID 80647983
6-N-(2-fluoro-4-methylphenyl)pyridine-2,6-diamine
CID 80646846
6-N-(4-chloro-2-fluorophenyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717889
2-N-(4-chloro-2-fluorophenyl)-6-methoxypyridine-2,5-diamine
CID 54954761
3-N-(4-chloro-2-fluorophenyl)benzene-1,3-diamine
CID 61469504
N-(2-bromo-4-chlorophenyl)-6-fluoropyridin-2-amine
CID 81281101
4-N-(4-chloro-2-fluorophenyl)-6-N-ethylpyrimidine-2,4,6-triamine
CID 80801126
N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80897846
1-N-(4-chloro-2-fluorophenyl)-2,6-difluorobenzene-1,4-diamine
CID 54954908
6-N-(2-methylsulfanylphenyl)pyridine-2,6-diamine
CID 107647058
6-N-[3-chloro-5-(trifluoromethyl)phenyl]pyridine-2,6-diamine
CID 116700995
6-N-[(3-chloro-4-fluorophenyl)methyl]pyridine-2,6-diamine
CID 80647965

Frequently Asked Questions

What is the IUPAC name of 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine (CID 80653049) is 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine is Nc1cccc(Nc2ccc(Cl)cc2F)n1.
What is the InChIKey of 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine?
The InChIKey is HINHCJQIJWDHCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClFN3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16).
What are the key properties of 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine?
6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine has a molecular weight of 237.67 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(4-chloro-2-fluorophenyl)pyridine-2,6-diamine is sourced from PubChem (CID 80653049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).