[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine

C7H6BrF3N2 — CID 118808600

IUPAC[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine
SMILESNCc1nc(C(F)F)cc(Br)c1F
InChIInChI=1S/C7H6BrF3N2/c8-3-1-4(7(10)11)13-5(2-12)6(3)9/h1,7H,2,12H2
InChIKeyGYKUEOKMFMMKPO-UHFFFAOYSA-N
MW255.04 g/mol
LogP2.38
Rot. Bonds2

About [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine

[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine (PubChem CID 118808600) has the molecular formula C7H6BrF3N2 and a molecular weight of 255.04 g/mol. Its IUPAC name is [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine
PubChem CID118808600
Molecular FormulaC7H6BrF3N2
Molecular Weight255.04 g/mol
Exact Mass253.97
IUPAC Name[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine
SMILESNCc1nc(C(F)F)cc(Br)c1F
InChIInChI=1S/C7H6BrF3N2/c8-3-1-4(7(10)11)13-5(2-12)6(3)9/h1,7H,2,12H2
InChIKeyGYKUEOKMFMMKPO-UHFFFAOYSA-N
XLogP2.38
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.04
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-bromo-6-(difluoromethyl)-3-methyl-2-pyridinyl]methanamine
CID 118814262
[6-(difluoromethyl)-3-fluoro-4-iodo-2-pyridinyl]methanamine
CID 118820195
[6-(difluoromethyl)-3-fluoro-4-methyl-2-pyridinyl]methanamine
CID 118848345
[3-bromo-4-chloro-6-(difluoromethyl)-2-pyridinyl]methanamine
CID 118820044
2-(aminomethyl)-6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 118836753
[4-bromo-3-(difluoromethyl)-6-fluoro-2-pyridinyl]methanamine
CID 118803186
4-amino-2-(aminomethyl)-6-(difluoromethyl)pyridin-3-ol
CID 118818065
2-[2-(aminomethyl)-6-(difluoromethyl)-4-fluoro-3-pyridinyl]acetonitrile
CID 118825820
2-(aminomethyl)-6-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
CID 118823621
2-[4-(aminomethyl)-6-(difluoromethyl)-3-fluoro-2-pyridinyl]acetonitrile
CID 118806694
[4-bromo-2-(chloromethyl)-6-(difluoromethyl)-3-pyridinyl]methanol
CID 130070605
[3-bromo-2-(difluoromethyl)-6-fluoro-4-pyridinyl]methanamine
CID 118823517

Frequently Asked Questions

What is the IUPAC name of [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine?
The IUPAC name of [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine (CID 118808600) is [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine.
What is the SMILES notation for [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine?
The canonical SMILES for [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine is NCc1nc(C(F)F)cc(Br)c1F.
What is the InChIKey of [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine?
The InChIKey is GYKUEOKMFMMKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrF3N2/c8-3-1-4(7(10)11)13-5(2-12)6(3)9/h1,7H,2,12H2.
What are the key properties of [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine?
[4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine has a molecular weight of 255.04 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-bromo-6-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine is sourced from PubChem (CID 118808600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).