3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine

C11H6BrClF2N2 — CID 114836633

IUPAC3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
SMILESFc1cc(F)cc(Nc2ncc(Cl)cc2Br)c1
InChIInChI=1S/C11H6BrClF2N2/c12-10-1-6(13)5-16-11(10)17-9-3-7(14)2-8(15)4-9/h1-5H,(H,16,17)
InChIKeyISRCGOWDPOWRGF-UHFFFAOYSA-N
MW319.54 g/mol
LogP4.52
Rot. Bonds2

About 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine

3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine (PubChem CID 114836633) has the molecular formula C11H6BrClF2N2 and a molecular weight of 319.54 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
PubChem CID114836633
Molecular FormulaC11H6BrClF2N2
Molecular Weight319.54 g/mol
Exact Mass317.94
IUPAC Name3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
SMILESFc1cc(F)cc(Nc2ncc(Cl)cc2Br)c1
InChIInChI=1S/C11H6BrClF2N2/c12-10-1-6(13)5-16-11(10)17-9-3-7(14)2-8(15)4-9/h1-5H,(H,16,17)
InChIKeyISRCGOWDPOWRGF-UHFFFAOYSA-N
XLogP4.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.54
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridin-2-amine
CID 114837355
5-bromo-2-chloro-N-(3,5-difluorophenyl)pyrimidin-4-amine
CID 79076577
3-bromo-5-chloro-N-thiophen-3-ylpyridin-2-amine
CID 114837216
3-N-(3-bromo-5-chloro-2-pyridinyl)benzene-1,3-diamine
CID 114835563
3-bromo-N-(3-bromo-5-methoxyphenyl)-5-chloropyridin-2-amine
CID 114837346
3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine
CID 114836558
N-(1,3-benzodioxol-5-yl)-3-bromo-5-chloropyridin-2-amine
CID 114836575
3-bromo-5-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 114836581
3-bromo-5-chloro-N-(2-chloro-6-fluorophenyl)pyridin-2-amine
CID 114837428
5-chloro-N-(3,5-dimethylphenyl)-3-fluoropyridin-2-amine
CID 79727161
3-bromo-5-chloro-N-methylpyridin-2-amine
CID 51356623
3-bromo-5-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridin-2-amine
CID 114836561

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine (CID 114836633) is 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine is Fc1cc(F)cc(Nc2ncc(Cl)cc2Br)c1.
What is the InChIKey of 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine?
The InChIKey is ISRCGOWDPOWRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrClF2N2/c12-10-1-6(13)5-16-11(10)17-9-3-7(14)2-8(15)4-9/h1-5H,(H,16,17).
What are the key properties of 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine?
3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine has a molecular weight of 319.54 g/mol, XLogP of 4.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine is sourced from PubChem (CID 114836633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).