6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine

C6H4BrF2IN2 — CID 119005201

IUPAC6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine
SMILESNc1nc(Br)cc(C(F)F)c1I
InChIInChI=1S/C6H4BrF2IN2/c7-3-1-2(5(8)9)4(10)6(11)12-3/h1,5H,(H2,11,12)
InChIKeyDICTYCJWNMUQQM-UHFFFAOYSA-N
MW348.92 g/mol
LogP2.97
Rot. Bonds1

About 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine

6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine (PubChem CID 119005201) has the molecular formula C6H4BrF2IN2 and a molecular weight of 348.92 g/mol. Its IUPAC name is 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine.

Molecular Properties

Compound Name6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine
PubChem CID119005201
Molecular FormulaC6H4BrF2IN2
Molecular Weight348.92 g/mol
Exact Mass347.86
IUPAC Name6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine
SMILESNc1nc(Br)cc(C(F)F)c1I
InChIInChI=1S/C6H4BrF2IN2/c7-3-1-2(5(8)9)4(10)6(11)12-3/h1,5H,(H2,11,12)
InChIKeyDICTYCJWNMUQQM-UHFFFAOYSA-N
XLogP2.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.92
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-4-(difluoromethyl)pyridine-2,3-diamine
CID 130098542
6-bromo-2-chloro-4-(difluoromethyl)-3-iodopyridine
CID 130107870
6-bromo-4-(difluoromethyl)-3-(trifluoromethyl)pyridin-2-amine
CID 118995559
[6-bromo-4-(difluoromethyl)-3-iodo-2-pyridinyl]methanol
CID 130068357
2-amino-6-bromo-4-(difluoromethyl)pyridine-3-carboxylic acid
CID 119014355
2-amino-6-bromo-4-(difluoromethyl)pyridine-3-carboxamide
CID 118999240
6-bromo-4-(difluoromethyl)-3-iodopyridine-2-carboxylic acid
CID 130068422
4-(difluoromethyl)-3-iodo-6-nitropyridin-2-amine
CID 119004202
methyl 6-amino-4-(difluoromethyl)-5-iodopyridine-2-carboxylate
CID 130105555
[6-bromo-4-(difluoromethyl)-2-methyl-3-pyridinyl]methanamine
CID 130069170
5-(difluoromethyl)-6-iodopyridine-2,3-diamine
CID 118990847
6-bromo-3-(difluoromethyl)pyridine-2,5-diamine
CID 119017284

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine?
The IUPAC name of 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine (CID 119005201) is 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine.
What is the SMILES notation for 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine?
The canonical SMILES for 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine is Nc1nc(Br)cc(C(F)F)c1I.
What is the InChIKey of 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine?
The InChIKey is DICTYCJWNMUQQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrF2IN2/c7-3-1-2(5(8)9)4(10)6(11)12-3/h1,5H,(H2,11,12).
What are the key properties of 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine?
6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine has a molecular weight of 348.92 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-(difluoromethyl)-3-iodopyridin-2-amine is sourced from PubChem (CID 119005201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).