6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine

C7H6BrClF2N2 — CID 130101938

IUPAC6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine
SMILESNc1cc(C(F)F)c(CCl)c(Br)n1
InChIInChI=1S/C7H6BrClF2N2/c8-6-4(2-9)3(7(10)11)1-5(12)13-6/h1,7H,2H2,(H2,12,13)
InChIKeyOLVPFOVPWUDFJE-UHFFFAOYSA-N
MW271.49 g/mol
LogP3.10
Rot. Bonds2

About 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine

6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine (PubChem CID 130101938) has the molecular formula C7H6BrClF2N2 and a molecular weight of 271.49 g/mol. Its IUPAC name is 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine
PubChem CID130101938
Molecular FormulaC7H6BrClF2N2
Molecular Weight271.49 g/mol
Exact Mass269.94
IUPAC Name6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine
SMILESNc1cc(C(F)F)c(CCl)c(Br)n1
InChIInChI=1S/C7H6BrClF2N2/c8-6-4(2-9)3(7(10)11)1-5(12)13-6/h1,7H,2H2,(H2,12,13)
InChIKeyOLVPFOVPWUDFJE-UHFFFAOYSA-N
XLogP3.10
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.49
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-6-chloro-3-(chloromethyl)-4-(difluoromethyl)pyridine
CID 119001903
methyl 2-[6-amino-2-bromo-4-(difluoromethyl)-3-pyridinyl]acetate
CID 134669816
6-(chloromethyl)-4-(difluoromethyl)-5-fluoropyridin-2-amine
CID 130104065
6-amino-2-bromo-4-(difluoromethyl)pyridine-3-carbonyl chloride
CID 130102254
6-(chloromethyl)-4-(difluoromethyl)-5-iodopyridin-2-amine
CID 130105343
3-bromo-4-(chloromethyl)-5-(difluoromethyl)pyridin-2-amine
CID 118998627
2,6-dibromo-3-(chloromethyl)-5-(difluoromethyl)pyridine
CID 130099019
2-chloro-3-(chloromethyl)-4-(difluoromethyl)-6-iodopyridine
CID 119013287
2-bromo-6-chloro-5-(chloromethyl)-3-(difluoromethyl)pyridine
CID 119016714
2-chloro-3-(chloromethyl)-4-(difluoromethyl)-6-methylpyridine
CID 119013902
6-chloro-4-(difluoromethyl)-5-fluoropyridin-2-amine
CID 130102435
6-amino-4-(difluoromethyl)-3-(hydroxymethyl)pyridine-2-carbonitrile
CID 130103568

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine?
The IUPAC name of 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine (CID 130101938) is 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine is Nc1cc(C(F)F)c(CCl)c(Br)n1.
What is the InChIKey of 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine?
The InChIKey is OLVPFOVPWUDFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrClF2N2/c8-6-4(2-9)3(7(10)11)1-5(12)13-6/h1,7H,2H2,(H2,12,13).
What are the key properties of 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine?
6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine has a molecular weight of 271.49 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-(chloromethyl)-4-(difluoromethyl)pyridin-2-amine is sourced from PubChem (CID 130101938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).