6-bromo-2-propan-2-ylpyridin-3-amine

C8H11BrN2 — CID 141017784

IUPAC6-bromo-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1nc(Br)ccc1N
InChIInChI=1S/C8H11BrN2/c1-5(2)8-6(10)3-4-7(9)11-8/h3-5H,10H2,1-2H3
InChIKeyPJJIEJRPKKJLJD-UHFFFAOYSA-N
MW215.09 g/mol
LogP2.55
Rot. Bonds1

About 6-bromo-2-propan-2-ylpyridin-3-amine

6-bromo-2-propan-2-ylpyridin-3-amine (PubChem CID 141017784) has the molecular formula C8H11BrN2 and a molecular weight of 215.09 g/mol. Its IUPAC name is 6-bromo-2-propan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-propan-2-ylpyridin-3-amine
PubChem CID141017784
Molecular FormulaC8H11BrN2
Molecular Weight215.09 g/mol
Exact Mass214.01
IUPAC Name6-bromo-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1nc(Br)ccc1N
InChIInChI=1S/C8H11BrN2/c1-5(2)8-6(10)3-4-7(9)11-8/h3-5H,10H2,1-2H3
InChIKeyPJJIEJRPKKJLJD-UHFFFAOYSA-N
XLogP2.55
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.09
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-bromo-2-propan-2-ylpyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-bromo-2-propan-2-ylpyridine-3,4-diamine
CID 144632858
CID 89035932
CID 89035932
1-(6-bromo-3-chloro-2-pyridinyl)ethanol
CID 86667924
2-methyl-4-propan-2-ylpyrimidin-5-amine
CID 82372486
(3-amino-6-bromo-2-pyridinyl)methanol
CID 71299881
6-bromo-2-methyl-3-propan-2-ylpyridine
CID 143746105
3-bromo-6-methoxy-2-propan-2-ylpyridine
CID 70868100
5-bromo-2-phenyl-6-propan-2-ylpyrimidin-4-amine
CID 66299701
1-(3-amino-6-methoxy-2-pyridinyl)-3-bromopropane-1,2-diol
CID 171859985
2-(3-amino-6-bromo-2-pyridinyl)acetonitrile
CID 131117863
(3-amino-6-bromo-2-pyridinyl) formate
CID 121338217
3-bromo-2-propan-2-ylimidazo[1,2-a]pyridin-5-amine
CID 83693304

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-propan-2-ylpyridin-3-amine?
The IUPAC name of 6-bromo-2-propan-2-ylpyridin-3-amine (CID 141017784) is 6-bromo-2-propan-2-ylpyridin-3-amine.
What is the SMILES notation for 6-bromo-2-propan-2-ylpyridin-3-amine?
The canonical SMILES for 6-bromo-2-propan-2-ylpyridin-3-amine is CC(C)c1nc(Br)ccc1N.
What is the InChIKey of 6-bromo-2-propan-2-ylpyridin-3-amine?
The InChIKey is PJJIEJRPKKJLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2/c1-5(2)8-6(10)3-4-7(9)11-8/h3-5H,10H2,1-2H3.
What are the key properties of 6-bromo-2-propan-2-ylpyridin-3-amine?
6-bromo-2-propan-2-ylpyridin-3-amine has a molecular weight of 215.09 g/mol, XLogP of 2.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 141017784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).