6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine

C6H4BrClF2N2 — CID 130101605

IUPAC6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
SMILESNc1c(Cl)cc(Br)nc1C(F)F
InChIInChI=1S/C6H4BrClF2N2/c7-3-1-2(8)4(11)5(12-3)6(9)10/h1,6H,11H2
InChIKeyCJWCFUQBULSKQH-UHFFFAOYSA-N
MW257.46 g/mol
LogP3.02
Rot. Bonds1

About 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine

6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine (PubChem CID 130101605) has the molecular formula C6H4BrClF2N2 and a molecular weight of 257.46 g/mol. Its IUPAC name is 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
PubChem CID130101605
Molecular FormulaC6H4BrClF2N2
Molecular Weight257.46 g/mol
Exact Mass255.92
IUPAC Name6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
SMILESNc1c(Cl)cc(Br)nc1C(F)F
InChIInChI=1S/C6H4BrClF2N2/c7-3-1-2(8)4(11)5(12-3)6(9)10/h1,6H,11H2
InChIKeyCJWCFUQBULSKQH-UHFFFAOYSA-N
XLogP3.02
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130107863
2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
CID 118834001
5-amino-4-chloro-6-(difluoromethyl)pyridine-2-carbonitrile
CID 130102414
5-amino-4-chloro-6-(difluoromethyl)pyridine-2-sulfonamide
CID 130103115
4-chloro-2-(difluoromethyl)-6-nitropyridin-3-amine
CID 130102612
3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
CID 119012391
6-bromo-3-chloro-2-(difluoromethyl)-4-iodopyridine
CID 130107866
6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine
CID 130108046
4,6-dibromo-2-(difluoromethyl)-3-fluoropyridine
CID 130098882
methyl 2-[5-amino-4-chloro-6-(difluoromethyl)-2-pyridinyl]acetate
CID 133088393
4-(aminomethyl)-6-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130102649
6-bromo-4-(difluoromethyl)pyridine-2,3-diamine
CID 130098542

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine?
The IUPAC name of 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine (CID 130101605) is 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine.
What is the SMILES notation for 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine?
The canonical SMILES for 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine is Nc1c(Cl)cc(Br)nc1C(F)F.
What is the InChIKey of 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine?
The InChIKey is CJWCFUQBULSKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClF2N2/c7-3-1-2(8)4(11)5(12-3)6(9)10/h1,6H,11H2.
What are the key properties of 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine?
6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine has a molecular weight of 257.46 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine is sourced from PubChem (CID 130101605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).