2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine

C10H16BrN3 — CID 83693497

IUPAC2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine
SMILESCc1nc2n(c1Br)CCC(CCN)C2
InChIInChI=1S/C10H16BrN3/c1-7-10(11)14-5-3-8(2-4-12)6-9(14)13-7/h8H,2-6,12H2,1H3
InChIKeyGTLUDJXPSNOSKW-UHFFFAOYSA-N
MW258.16 g/mol
LogP1.87
Rot. Bonds2

About 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine

2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine (PubChem CID 83693497) has the molecular formula C10H16BrN3 and a molecular weight of 258.16 g/mol. Its IUPAC name is 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine.

Molecular Properties

Compound Name2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine
PubChem CID83693497
Molecular FormulaC10H16BrN3
Molecular Weight258.16 g/mol
Exact Mass257.05
IUPAC Name2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine
SMILESCc1nc2n(c1Br)CCC(CCN)C2
InChIInChI=1S/C10H16BrN3/c1-7-10(11)14-5-3-8(2-4-12)6-9(14)13-7/h8H,2-6,12H2,1H3
InChIKeyGTLUDJXPSNOSKW-UHFFFAOYSA-N
XLogP1.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.16
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine?
The IUPAC name of 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine (CID 83693497) is 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine.
What is the SMILES notation for 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine?
The canonical SMILES for 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine is Cc1nc2n(c1Br)CCC(CCN)C2.
What is the InChIKey of 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine?
The InChIKey is GTLUDJXPSNOSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN3/c1-7-10(11)14-5-3-8(2-4-12)6-9(14)13-7/h8H,2-6,12H2,1H3.
What are the key properties of 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine?
2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine has a molecular weight of 258.16 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanamine is sourced from PubChem (CID 83693497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).