6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine

C11H8BrCl2N3 — CID 102755131

IUPAC6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine
SMILESNc1nc(Nc2ccc(Br)cc2)c(Cl)cc1Cl
InChIInChI=1S/C11H8BrCl2N3/c12-6-1-3-7(4-2-6)16-11-9(14)5-8(13)10(15)17-11/h1-5H,(H3,15,16,17)
InChIKeyPVBTWNJIYZJLPF-UHFFFAOYSA-N
MW333.02 g/mol
LogP4.48
Rot. Bonds2

About 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine

6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine (PubChem CID 102755131) has the molecular formula C11H8BrCl2N3 and a molecular weight of 333.02 g/mol. Its IUPAC name is 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine
PubChem CID102755131
Molecular FormulaC11H8BrCl2N3
Molecular Weight333.02 g/mol
Exact Mass330.93
IUPAC Name6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine
SMILESNc1nc(Nc2ccc(Br)cc2)c(Cl)cc1Cl
InChIInChI=1S/C11H8BrCl2N3/c12-6-1-3-7(4-2-6)16-11-9(14)5-8(13)10(15)17-11/h1-5H,(H3,15,16,17)
InChIKeyPVBTWNJIYZJLPF-UHFFFAOYSA-N
XLogP4.48
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.02
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-N-(4-fluorophenyl)pyridine-2,6-diamine
CID 102755142
3,5-dichloro-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-diamine
CID 102756297
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-(2-bromo-4-iodophenyl)-3,5-dichloropyridine-2,6-diamine
CID 114261721
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
6-N-(4-bromophenyl)-4-N-(3,5-dichlorophenyl)pyrimidine-4,5,6-triamine
CID 22544983
N-(3-bromophenyl)-3,5,6-trichloropyridin-2-amine
CID 102750053
4-N-(5-bromo-2-chlorophenyl)benzene-1,4-diamine
CID 62913398
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
3,5,6-trichloro-N-(4-methoxyphenyl)pyridin-2-amine
CID 102749971

Frequently Asked Questions

What is the IUPAC name of 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine?
The IUPAC name of 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine (CID 102755131) is 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine.
What is the SMILES notation for 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine?
The canonical SMILES for 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine is Nc1nc(Nc2ccc(Br)cc2)c(Cl)cc1Cl.
What is the InChIKey of 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine?
The InChIKey is PVBTWNJIYZJLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrCl2N3/c12-6-1-3-7(4-2-6)16-11-9(14)5-8(13)10(15)17-11/h1-5H,(H3,15,16,17).
What are the key properties of 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine?
6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine has a molecular weight of 333.02 g/mol, XLogP of 4.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(4-bromophenyl)-3,5-dichloropyridine-2,6-diamine is sourced from PubChem (CID 102755131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).