[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine

C14H12BrN3 — CID 117138416

IUPAC[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(-c3ccc(Br)cc3)n2c1
InChIInChI=1S/C14H12BrN3/c15-12-4-2-11(3-5-12)14-17-8-13-6-1-10(7-16)9-18(13)14/h1-6,8-9H,7,16H2
InChIKeyATUKHJBJUBGOLK-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.22
Rot. Bonds2

About [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine

[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine (PubChem CID 117138416) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
PubChem CID117138416
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(-c3ccc(Br)cc3)n2c1
InChIInChI=1S/C14H12BrN3/c15-12-4-2-11(3-5-12)14-17-8-13-6-1-10(7-16)9-18(13)14/h1-6,8-9H,7,16H2
InChIKeyATUKHJBJUBGOLK-UHFFFAOYSA-N
XLogP3.22
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(5-bromothiophen-2-yl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138325
4-(6-bromoimidazo[1,5-a]pyridin-3-yl)aniline
CID 117158440
[3-(3-methoxyphenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138394
[3-[(2-bromophenyl)methyl]imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138359
3-(6-bromoimidazo[1,5-a]pyridin-3-yl)aniline
CID 117158425
6-bromo-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine
CID 117139659
(3-piperidin-2-ylimidazo[1,5-a]pyridin-6-yl)methanamine
CID 117138268
(3-piperidin-4-ylimidazo[1,5-a]pyridin-6-yl)methanamine
CID 117138198
[3-(1-methylpiperidin-2-yl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138269
[2-(4-bromophenyl)-1-methylimidazol-4-yl]methanamine
CID 82304335
3-(6-bromoimidazo[1,5-a]pyridin-3-yl)benzoic acid
CID 117158432
[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138282

Frequently Asked Questions

What is the IUPAC name of [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The IUPAC name of [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine (CID 117138416) is [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The canonical SMILES for [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine is NCc1ccc2cnc(-c3ccc(Br)cc3)n2c1.
What is the InChIKey of [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The InChIKey is ATUKHJBJUBGOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c15-12-4-2-11(3-5-12)14-17-8-13-6-1-10(7-16)9-18(13)14/h1-6,8-9H,7,16H2.
What are the key properties of [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
[3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine has a molecular weight of 302.18 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-bromophenyl)imidazo[1,5-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 117138416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).