N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine

C12H16BrN3 — CID 115651962

IUPACN-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cnc2ccc(Br)cn12
InChIInChI=1S/C12H16BrN3/c1-12(2,3)15-7-10-6-14-11-5-4-9(13)8-16(10)11/h4-6,8,15H,7H2,1-3H3
InChIKeyVZDYVFFGEIIKDL-UHFFFAOYSA-N
MW282.19 g/mol
LogP2.98
Rot. Bonds2

About N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine

N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine (PubChem CID 115651962) has the molecular formula C12H16BrN3 and a molecular weight of 282.19 g/mol. Its IUPAC name is N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine
PubChem CID115651962
Molecular FormulaC12H16BrN3
Molecular Weight282.19 g/mol
Exact Mass281.05
IUPAC NameN-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cnc2ccc(Br)cn12
InChIInChI=1S/C12H16BrN3/c1-12(2,3)15-7-10-6-14-11-5-4-9(13)8-16(10)11/h4-6,8,15H,7H2,1-3H3
InChIKeyVZDYVFFGEIIKDL-UHFFFAOYSA-N
XLogP2.98
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.19
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine (CID 115651962) is N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cnc2ccc(Br)cn12.
What is the InChIKey of N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine?
The InChIKey is VZDYVFFGEIIKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrN3/c1-12(2,3)15-7-10-6-14-11-5-4-9(13)8-16(10)11/h4-6,8,15H,7H2,1-3H3.
What are the key properties of N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine?
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine has a molecular weight of 282.19 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 115651962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).