N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine

C15H13BrClN5 — CID 134300738

IUPACN-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
SMILESClc1ccc2ncc(-c3cc(Br)cc(NC4CNC4)n3)n2c1
InChIInChI=1S/C15H13BrClN5/c16-9-3-12(21-14(4-9)20-11-5-18-6-11)13-7-19-15-2-1-10(17)8-22(13)15/h1-4,7-8,11,18H,5-6H2,(H,20,21)
InChIKeyWOSLMSZLBXKLKX-UHFFFAOYSA-N
MW378.66 g/mol
LogP3.20
Rot. Bonds3

About N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine

N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine (PubChem CID 134300738) has the molecular formula C15H13BrClN5 and a molecular weight of 378.66 g/mol. Its IUPAC name is N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
PubChem CID134300738
Molecular FormulaC15H13BrClN5
Molecular Weight378.66 g/mol
Exact Mass377.00
IUPAC NameN-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
SMILESClc1ccc2ncc(-c3cc(Br)cc(NC4CNC4)n3)n2c1
InChIInChI=1S/C15H13BrClN5/c16-9-3-12(21-14(4-9)20-11-5-18-6-11)13-7-19-15-2-1-10(17)8-22(13)15/h1-4,7-8,11,18H,5-6H2,(H,20,21)
InChIKeyWOSLMSZLBXKLKX-UHFFFAOYSA-N
XLogP3.20
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.66
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine (CID 134300738) is N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine is Clc1ccc2ncc(-c3cc(Br)cc(NC4CNC4)n3)n2c1.
What is the InChIKey of N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The InChIKey is WOSLMSZLBXKLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClN5/c16-9-3-12(21-14(4-9)20-11-5-18-6-11)13-7-19-15-2-1-10(17)8-22(13)15/h1-4,7-8,11,18H,5-6H2,(H,20,21).
What are the key properties of N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine has a molecular weight of 378.66 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-4-bromo-6-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine is sourced from PubChem (CID 134300738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).