4-bromo-N,N-dimethylpyridin-3-amine

C7H9BrN2 — CID 23436877

IUPAC4-bromo-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1cnccc1Br
InChIInChI=1S/C7H9BrN2/c1-10(2)7-5-9-4-3-6(7)8/h3-5H,1-2H3
InChIKeyQMJRMNZHXCWZAL-UHFFFAOYSA-N
MW201.07 g/mol
LogP1.91
Rot. Bonds1

About 4-bromo-N,N-dimethylpyridin-3-amine

4-bromo-N,N-dimethylpyridin-3-amine (PubChem CID 23436877) has the molecular formula C7H9BrN2 and a molecular weight of 201.07 g/mol. Its IUPAC name is 4-bromo-N,N-dimethylpyridin-3-amine.

Molecular Properties

Compound Name4-bromo-N,N-dimethylpyridin-3-amine
PubChem CID23436877
Molecular FormulaC7H9BrN2
Molecular Weight201.07 g/mol
Exact Mass199.99
IUPAC Name4-bromo-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1cnccc1Br
InChIInChI=1S/C7H9BrN2/c1-10(2)7-5-9-4-3-6(7)8/h3-5H,1-2H3
InChIKeyQMJRMNZHXCWZAL-UHFFFAOYSA-N
XLogP1.91
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.07
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-Diaminopyridine
CID 5918
3-Aminopyridine
CID 10009
4-(Dimethylamino)pyridine
CID 14284
2-Bromopyridine
CID 7973
3-Bromopyridine
CID 12286
4-Amino-3-bromopyridine
CID 26095
6-Bromopyridin-3-amine
CID 642811
3-Amino-5-bromopyridine
CID 817681
2-(Dimethylaminomethyl)-pyridine
CID 252482
1-(6-Bromopyridin-3-yl)-1,4-diazepane
CID 10131290
4-Bromo-2-fluoropyridine
CID 2762851
1-Methyl-4-(pyridin-3-yl)piperazine
CID 10058072

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N,N-dimethylpyridin-3-amine?
The IUPAC name of 4-bromo-N,N-dimethylpyridin-3-amine (CID 23436877) is 4-bromo-N,N-dimethylpyridin-3-amine.
What is the SMILES notation for 4-bromo-N,N-dimethylpyridin-3-amine?
The canonical SMILES for 4-bromo-N,N-dimethylpyridin-3-amine is CN(C)c1cnccc1Br.
What is the InChIKey of 4-bromo-N,N-dimethylpyridin-3-amine?
The InChIKey is QMJRMNZHXCWZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2/c1-10(2)7-5-9-4-3-6(7)8/h3-5H,1-2H3.
What are the key properties of 4-bromo-N,N-dimethylpyridin-3-amine?
4-bromo-N,N-dimethylpyridin-3-amine has a molecular weight of 201.07 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N,N-dimethylpyridin-3-amine is sourced from PubChem (CID 23436877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).