4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline

C14H12BrN3 — CID 82059906

IUPAC4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1cc(Br)cn2cc(-c3ccc(N)cc3)nc12
InChIInChI=1S/C14H12BrN3/c1-9-6-11(15)7-18-8-13(17-14(9)18)10-2-4-12(16)5-3-10/h2-8H,16H2,1H3
InChIKeyALJCMYJBQKCMCR-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.65
Rot. Bonds1

About 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline

4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline (PubChem CID 82059906) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline.

Molecular Properties

Compound Name4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline
PubChem CID82059906
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1cc(Br)cn2cc(-c3ccc(N)cc3)nc12
InChIInChI=1S/C14H12BrN3/c1-9-6-11(15)7-18-8-13(17-14(9)18)10-2-4-12(16)5-3-10/h2-8H,16H2,1H3
InChIKeyALJCMYJBQKCMCR-UHFFFAOYSA-N
XLogP3.65
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-bromo-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine
CID 82059448
6-bromo-2-(3,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridine
CID 46307191
6-bromo-2-(3,5-difluorophenyl)-8-methylimidazo[1,2-a]pyridine
CID 83170503
6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine
CID 83170739
8-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-6-amine
CID 82059068
6-bromo-2-(5-chlorothiophen-2-yl)-8-methylimidazo[1,2-a]pyridine
CID 83170108
8-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-6-amine
CID 112555626
2-(4-bromophenyl)-8-methylimidazo[1,2-a]pyridine
CID 4715410
2-(4-bromophenyl)-8-methylimidazo[1,2-a]pyridine;hydrobromide
CID 67123054
6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 83169792
8-methyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-6-amine
CID 115910845
8-methyl-2-(2,4,6-trimethylphenyl)imidazo[1,2-a]pyridin-6-amine
CID 115910852

Frequently Asked Questions

What is the IUPAC name of 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The IUPAC name of 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline (CID 82059906) is 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline.
What is the SMILES notation for 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The canonical SMILES for 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline is Cc1cc(Br)cn2cc(-c3ccc(N)cc3)nc12.
What is the InChIKey of 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The InChIKey is ALJCMYJBQKCMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c1-9-6-11(15)7-18-8-13(17-14(9)18)10-2-4-12(16)5-3-10/h2-8H,16H2,1H3.
What are the key properties of 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline?
4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline has a molecular weight of 302.18 g/mol, XLogP of 3.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)aniline is sourced from PubChem (CID 82059906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).