2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine

C12H10BrClN2O — CID 166801250

IUPAC2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine
SMILESCOc1cccc(Br)c1-c1ncc(Cl)cc1N
InChIInChI=1S/C12H10BrClN2O/c1-17-10-4-2-3-8(13)11(10)12-9(15)5-7(14)6-16-12/h2-6H,15H2,1H3
InChIKeyGMUDOKHSAHSPMY-UHFFFAOYSA-N
MW313.58 g/mol
LogP3.76
Rot. Bonds2

About 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine

2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine (PubChem CID 166801250) has the molecular formula C12H10BrClN2O and a molecular weight of 313.58 g/mol. Its IUPAC name is 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine.

Molecular Properties

Compound Name2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine
PubChem CID166801250
Molecular FormulaC12H10BrClN2O
Molecular Weight313.58 g/mol
Exact Mass311.97
IUPAC Name2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine
SMILESCOc1cccc(Br)c1-c1ncc(Cl)cc1N
InChIInChI=1S/C12H10BrClN2O/c1-17-10-4-2-3-8(13)11(10)12-9(15)5-7(14)6-16-12/h2-6H,15H2,1H3
InChIKeyGMUDOKHSAHSPMY-UHFFFAOYSA-N
XLogP3.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.58
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-bromo-6-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117453066
2-[(3-amino-5-chloro-2-pyridinyl)amino]-3-methoxybenzonitrile
CID 107466443
5-chloro-2-phenylpyridin-3-amine
CID 46311799
4-bromo-5-methoxy-9H-fluorene
CID 151444335
3-(2-bromo-6-methoxyphenyl)-5-(3-chlorophenyl)-1,2-oxazole
CID 118371898
3,5-dichloro-6-(2,6-dimethoxyphenyl)pyridin-2-amine
CID 102753973
3-bromo-5-chloro-N-[(2-chloro-6-methoxyphenyl)methyl]pyridin-2-amine
CID 103292888
5-cyclopropyl-2-(2-methoxyphenyl)pyridin-3-amine
CID 83919445
5-[(2-bromo-6-methoxyphenoxy)methyl]-2-methoxyaniline
CID 83141041
6-(2,6-dimethoxyphenyl)pyridin-3-amine
CID 83918397
5-(2-chloro-6-methoxyphenyl)pyrazin-2-amine
CID 39826444
3-(2,6-dimethoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 43158389

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine?
The IUPAC name of 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine (CID 166801250) is 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine.
What is the SMILES notation for 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine?
The canonical SMILES for 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine is COc1cccc(Br)c1-c1ncc(Cl)cc1N.
What is the InChIKey of 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine?
The InChIKey is GMUDOKHSAHSPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClN2O/c1-17-10-4-2-3-8(13)11(10)12-9(15)5-7(14)6-16-12/h2-6H,15H2,1H3.
What are the key properties of 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine?
2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine has a molecular weight of 313.58 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-6-methoxyphenyl)-5-chloropyridin-3-amine is sourced from PubChem (CID 166801250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).