5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine

C15H17BrN2O — CID 115148485

IUPAC5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine
SMILESCOc1ccc(C)cc1N(C)c1ncc(Br)cc1C
InChIInChI=1S/C15H17BrN2O/c1-10-5-6-14(19-4)13(7-10)18(3)15-11(2)8-12(16)9-17-15/h5-9H,1-4H3
InChIKeyIWYSIXHTYTWBPT-UHFFFAOYSA-N
MW321.22 g/mol
LogP4.24
Rot. Bonds3

About 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine

5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine (PubChem CID 115148485) has the molecular formula C15H17BrN2O and a molecular weight of 321.22 g/mol. Its IUPAC name is 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine
PubChem CID115148485
Molecular FormulaC15H17BrN2O
Molecular Weight321.22 g/mol
Exact Mass320.05
IUPAC Name5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine
SMILESCOc1ccc(C)cc1N(C)c1ncc(Br)cc1C
InChIInChI=1S/C15H17BrN2O/c1-10-5-6-14(19-4)13(7-10)18(3)15-11(2)8-12(16)9-17-15/h5-9H,1-4H3
InChIKeyIWYSIXHTYTWBPT-UHFFFAOYSA-N
XLogP4.24
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.22
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(4-methoxy-3-methylphenyl)-N,3-dimethylpyridin-2-amine
CID 115148484
5-bromo-N-[(3-fluoro-4-methoxyphenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 115148613
5-bromo-N-[(2,5-dimethylphenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 115148609
N'-(5-bromo-3-methyl-2-pyridinyl)-N'-(2-methoxyphenyl)propane-1,3-diamine
CID 79712264
3-(aminomethyl)-5-bromo-N-(2,4-dimethylphenyl)-N-methylpyridin-2-amine
CID 55054981
6-ethyl-N-(2-methoxy-5-methylphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 46362708
5-bromo-N-[2-(2-methoxy-5-methylphenyl)ethyl]-3-methylpyridin-2-amine
CID 115148643
5-bromo-N-[(4-methoxyphenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 112697433
4-N-(2-methoxy-5-methylphenyl)-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265440
5-bromo-2-[(2-methoxy-4-methylphenoxy)methyl]pyridine
CID 113455729
1-methoxy-2,4-dimethyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 169444379
N-[4-(aminomethyl)phenyl]-5-bromo-N,3-dimethylpyridin-2-amine
CID 79712553

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine?
The IUPAC name of 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine (CID 115148485) is 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine is COc1ccc(C)cc1N(C)c1ncc(Br)cc1C.
What is the InChIKey of 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine?
The InChIKey is IWYSIXHTYTWBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O/c1-10-5-6-14(19-4)13(7-10)18(3)15-11(2)8-12(16)9-17-15/h5-9H,1-4H3.
What are the key properties of 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine?
5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine has a molecular weight of 321.22 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine is sourced from PubChem (CID 115148485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).