3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine

C11H9BrClN3 — CID 114837095

IUPAC3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine
SMILESCc1ccncc1Nc1ncc(Cl)cc1Br
InChIInChI=1S/C11H9BrClN3/c1-7-2-3-14-6-10(7)16-11-9(12)4-8(13)5-15-11/h2-6H,1H3,(H,15,16)
InChIKeyOBGLWUUIYMFRSX-UHFFFAOYSA-N
MW298.57 g/mol
LogP3.94
Rot. Bonds2

About 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine

3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine (PubChem CID 114837095) has the molecular formula C11H9BrClN3 and a molecular weight of 298.57 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine
PubChem CID114837095
Molecular FormulaC11H9BrClN3
Molecular Weight298.57 g/mol
Exact Mass296.97
IUPAC Name3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine
SMILESCc1ccncc1Nc1ncc(Cl)cc1Br
InChIInChI=1S/C11H9BrClN3/c1-7-2-3-14-6-10(7)16-11-9(12)4-8(13)5-15-11/h2-6H,1H3,(H,15,16)
InChIKeyOBGLWUUIYMFRSX-UHFFFAOYSA-N
XLogP3.94
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.57
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-5-chloro-N-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-2-amine
CID 114837222
3-bromo-N-(3-bromo-2-methylphenyl)-5-chloropyridin-2-amine
CID 107638006
3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine
CID 114836558
3-bromo-5-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 114836581
3-bromo-5-chloro-N-methylpyridin-2-amine
CID 51356623
3-bromo-5-chloro-N-(2,4-dimethoxyphenyl)pyridin-2-amine
CID 114836602
5-bromo-6-(5-chloro-2-methylanilino)pyridine-3-carbonitrile
CID 84605251
N-[(2-bromo-5-chlorophenyl)methyl]-4-methylpyridin-3-amine
CID 66161162
3-bromo-5-chloro-N-ethylpyridin-2-amine
CID 114835594
3-bromo-5-chloro-N-[2-(trifluoromethoxy)phenyl]pyridin-2-amine
CID 114836594
3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
CID 114836633
2-bromo-6-[(4-methyl-3-pyridinyl)amino]benzonitrile
CID 114881036

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine (CID 114837095) is 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine is Cc1ccncc1Nc1ncc(Cl)cc1Br.
What is the InChIKey of 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine?
The InChIKey is OBGLWUUIYMFRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrClN3/c1-7-2-3-14-6-10(7)16-11-9(12)4-8(13)5-15-11/h2-6H,1H3,(H,15,16).
What are the key properties of 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine?
3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine has a molecular weight of 298.57 g/mol, XLogP of 3.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 114837095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).