5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine

C9H13BrN2 — CID 114870243

IUPAC5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine
SMILESCCN(C)c1cc(C)c(Br)cn1
InChIInChI=1S/C9H13BrN2/c1-4-12(3)9-5-7(2)8(10)6-11-9/h5-6H,4H2,1-3H3
InChIKeyQGDLVJKZCVGFTM-UHFFFAOYSA-N
MW229.12 g/mol
LogP2.61
Rot. Bonds2

About 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine

5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine (PubChem CID 114870243) has the molecular formula C9H13BrN2 and a molecular weight of 229.12 g/mol. Its IUPAC name is 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine
PubChem CID114870243
Molecular FormulaC9H13BrN2
Molecular Weight229.12 g/mol
Exact Mass228.03
IUPAC Name5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine
SMILESCCN(C)c1cc(C)c(Br)cn1
InChIInChI=1S/C9H13BrN2/c1-4-12(3)9-5-7(2)8(10)6-11-9/h5-6H,4H2,1-3H3
InChIKeyQGDLVJKZCVGFTM-UHFFFAOYSA-N
XLogP2.61
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.12
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(2-chloropropyl)-N,4-dimethylpyridin-2-amine
CID 114869917
5-bromo-N-(3,3-dimethylbutyl)-N,4-dimethylpyridin-2-amine
CID 115147222
5-bromo-N-(1-bromopropan-2-yl)-N,4-dimethylpyridin-2-amine
CID 114870004
2-[(5-bromo-4-methyl-2-pyridinyl)-methylamino]-N-ethylacetamide
CID 115773945
5-bromo-N-(cyclopentylmethyl)-N,4-dimethylpyridin-2-amine
CID 114870435
5-bromo-N,4-dimethyl-N-(4-methylpentyl)pyridin-2-amine
CID 115147221
[6-[ethyl(methyl)amino]-4-methyl-3-pyridinyl]methanol
CID 102545307
ethyl 3-[(5-bromo-4-methyl-2-pyridinyl)-methylamino]propanoate
CID 115899127
5-bromo-N-[(2,4-dimethylphenyl)methyl]-N,4-dimethylpyridin-2-amine
CID 115147167
3-[(5-bromo-4-methyl-2-pyridinyl)-methylamino]-2-methylpropanenitrile
CID 115898860
5-bromo-N-tert-butyl-N,4-dimethylpyridin-2-amine
CID 115147028
5-bromo-N-ethyl-4-methyl-N-phenylpyridin-2-amine
CID 114870215

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine?
The IUPAC name of 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine (CID 114870243) is 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine is CCN(C)c1cc(C)c(Br)cn1.
What is the InChIKey of 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine?
The InChIKey is QGDLVJKZCVGFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2/c1-4-12(3)9-5-7(2)8(10)6-11-9/h5-6H,4H2,1-3H3.
What are the key properties of 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine?
5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine has a molecular weight of 229.12 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethyl-N,4-dimethylpyridin-2-amine is sourced from PubChem (CID 114870243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).