1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine

C11H14BrN3 — CID 84808262

IUPAC1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1cc2ncc(Br)cc2[nH]1
InChIInChI=1S/C11H14BrN3/c1-11(2,13)5-8-4-9-10(15-8)3-7(12)6-14-9/h3-4,6,15H,5,13H2,1-2H3
InChIKeyMQUHLJPDWLYMLT-UHFFFAOYSA-N
MW268.16 g/mol
LogP2.61
Rot. Bonds2

About 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine

1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine (PubChem CID 84808262) has the molecular formula C11H14BrN3 and a molecular weight of 268.16 g/mol. Its IUPAC name is 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine
PubChem CID84808262
Molecular FormulaC11H14BrN3
Molecular Weight268.16 g/mol
Exact Mass267.04
IUPAC Name1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1cc2ncc(Br)cc2[nH]1
InChIInChI=1S/C11H14BrN3/c1-11(2,13)5-8-4-9-10(15-8)3-7(12)6-14-9/h3-4,6,15H,5,13H2,1-2H3
InChIKeyMQUHLJPDWLYMLT-UHFFFAOYSA-N
XLogP2.61
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.16
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine?
The IUPAC name of 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine (CID 84808262) is 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine.
What is the SMILES notation for 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine?
The canonical SMILES for 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine is CC(C)(N)Cc1cc2ncc(Br)cc2[nH]1.
What is the InChIKey of 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine?
The InChIKey is MQUHLJPDWLYMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3/c1-11(2,13)5-8-4-9-10(15-8)3-7(12)6-14-9/h3-4,6,15H,5,13H2,1-2H3.
What are the key properties of 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine?
1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine has a molecular weight of 268.16 g/mol, XLogP of 2.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-1H-pyrrolo[3,2-b]pyridin-2-yl)-2-methylpropan-2-amine is sourced from PubChem (CID 84808262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).