5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine

C13H15BrN4 — CID 155298292

IUPAC5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine
SMILESCc1cc(Nc2ccc(N(C)C)nc2)ncc1Br
InChIInChI=1S/C13H15BrN4/c1-9-6-12(15-8-11(9)14)17-10-4-5-13(16-7-10)18(2)3/h4-8H,1-3H3,(H,15,17)
InChIKeyIQYNZJMIZATWLD-UHFFFAOYSA-N
MW307.20 g/mol
LogP3.36
Rot. Bonds3

About 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine

5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine (PubChem CID 155298292) has the molecular formula C13H15BrN4 and a molecular weight of 307.20 g/mol. Its IUPAC name is 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine
PubChem CID155298292
Molecular FormulaC13H15BrN4
Molecular Weight307.20 g/mol
Exact Mass306.05
IUPAC Name5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine
SMILESCc1cc(Nc2ccc(N(C)C)nc2)ncc1Br
InChIInChI=1S/C13H15BrN4/c1-9-6-12(15-8-11(9)14)17-10-4-5-13(16-7-10)18(2)3/h4-8H,1-3H3,(H,15,17)
InChIKeyIQYNZJMIZATWLD-UHFFFAOYSA-N
XLogP3.36
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.20
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methyl-N-[6-(trifluoromethyl)-3-pyridinyl]pyridin-2-amine
CID 114870519
5-bromo-N-[4-(methoxymethyl)phenyl]-4-methylpyridin-2-amine
CID 114252835
5-bromo-4-methyl-N-[4-(2-methylpropyl)phenyl]pyridin-2-amine
CID 115146959
3-N-(5-bromo-4-methyl-2-pyridinyl)benzene-1,3-diamine
CID 114869099
N-(5-bromo-4-methyl-2-pyridinyl)-1,3-benzothiazol-6-amine
CID 107801119
5-[(5-bromo-4-methyl-2-pyridinyl)amino]-1,3-dihydrobenzimidazol-2-one
CID 115147001
5-bromo-N-(4-methoxy-3,5-dimethylphenyl)-4-methylpyridin-2-amine
CID 115147018
5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine
CID 114870130
5-bromo-N-(2,5-dimethylphenyl)-4-methylpyridin-2-amine
CID 114870190
5-bromo-N-(4-bromo-2-methylphenyl)-4-methylpyridin-2-amine
CID 114870136
5-bromo-N-(2-bromo-5-methylphenyl)-4-methylpyridin-2-amine
CID 114870518
5-N-[(4-bromo-5-methylthiophen-2-yl)methyl]-2-N,2-N-dimethylpyridine-2,5-diamine
CID 102832425

Frequently Asked Questions

What is the IUPAC name of 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine?
The IUPAC name of 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine (CID 155298292) is 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine?
The canonical SMILES for 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine is Cc1cc(Nc2ccc(N(C)C)nc2)ncc1Br.
What is the InChIKey of 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine?
The InChIKey is IQYNZJMIZATWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN4/c1-9-6-12(15-8-11(9)14)17-10-4-5-13(16-7-10)18(2)3/h4-8H,1-3H3,(H,15,17).
What are the key properties of 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine?
5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine has a molecular weight of 307.20 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(5-bromo-4-methyl-2-pyridinyl)-2-N,2-N-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 155298292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).