[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine

C15H14BrN3 — CID 117138359

IUPAC[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(Cc3ccccc3Br)n2c1
InChIInChI=1S/C15H14BrN3/c16-14-4-2-1-3-12(14)7-15-18-9-13-6-5-11(8-17)10-19(13)15/h1-6,9-10H,7-8,17H2
InChIKeySSANODQZINIIFK-UHFFFAOYSA-N
MW316.20 g/mol
LogP3.15
Rot. Bonds3

About [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine

[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine (PubChem CID 117138359) has the molecular formula C15H14BrN3 and a molecular weight of 316.20 g/mol. Its IUPAC name is [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine
PubChem CID117138359
Molecular FormulaC15H14BrN3
Molecular Weight316.20 g/mol
Exact Mass315.04
IUPAC Name[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(Cc3ccccc3Br)n2c1
InChIInChI=1S/C15H14BrN3/c16-14-4-2-1-3-12(14)7-15-18-9-13-6-5-11(8-17)10-19(13)15/h1-6,9-10H,7-8,17H2
InChIKeySSANODQZINIIFK-UHFFFAOYSA-N
XLogP3.15
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.20
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138416
3-[(2-bromophenyl)methyl]-7-methoxyimidazo[1,5-a]pyridine
CID 117143084
6-bromo-3-[(2-methoxyphenyl)methyl]imidazo[1,5-a]pyridine
CID 117139633
[3-(5-bromothiophen-2-yl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138325
[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138282
[6-[(2-bromophenyl)methoxy]-3-pyridinyl]methanamine
CID 82828442
6-bromo-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine
CID 117139659
2-(imidazo[1,5-a]pyridin-3-ylmethyl)phenol
CID 117139622
(3-piperidin-2-ylimidazo[1,5-a]pyridin-6-yl)methanamine
CID 117138268
(6-fluoroimidazo[1,5-a]pyridin-3-yl)methanamine
CID 83873255
3-(aminomethyl)imidazo[1,5-a]pyridin-6-ol
CID 105432043
7-bromo-3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 117144523

Frequently Asked Questions

What is the IUPAC name of [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine?
The IUPAC name of [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine (CID 117138359) is [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine?
The canonical SMILES for [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine is NCc1ccc2cnc(Cc3ccccc3Br)n2c1.
What is the InChIKey of [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine?
The InChIKey is SSANODQZINIIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3/c16-14-4-2-1-3-12(14)7-15-18-9-13-6-5-11(8-17)10-19(13)15/h1-6,9-10H,7-8,17H2.
What are the key properties of [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine?
[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine has a molecular weight of 316.20 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 117138359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).