2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile

C15H11BrN4 — CID 107936784

IUPAC2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile
SMILESCc1cc(Br)cn2c(N)c(-c3ccccc3C#N)nc12
InChIInChI=1S/C15H11BrN4/c1-9-6-11(16)8-20-14(18)13(19-15(9)20)12-5-3-2-4-10(12)7-17/h2-6,8H,18H2,1H3
InChIKeyROJCSSZCSMQIIE-UHFFFAOYSA-N
MW327.19 g/mol
LogP3.53
Rot. Bonds1

About 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile

2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile (PubChem CID 107936784) has the molecular formula C15H11BrN4 and a molecular weight of 327.19 g/mol. Its IUPAC name is 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile.

Molecular Properties

Compound Name2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile
PubChem CID107936784
Molecular FormulaC15H11BrN4
Molecular Weight327.19 g/mol
Exact Mass326.02
IUPAC Name2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile
SMILESCc1cc(Br)cn2c(N)c(-c3ccccc3C#N)nc12
InChIInChI=1S/C15H11BrN4/c1-9-6-11(16)8-20-14(18)13(19-15(9)20)12-5-3-2-4-10(12)7-17/h2-6,8H,18H2,1H3
InChIKeyROJCSSZCSMQIIE-UHFFFAOYSA-N
XLogP3.53
TPSA67.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.19
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-bromo-8-methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine
CID 83168312
6-bromo-8-methyl-2-pyridin-4-ylimidazo[1,2-a]pyridin-3-amine
CID 83171049
6-bromo-2-(furan-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83171050
6-bromo-2-(5-tert-butylthiophen-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83169661
2-(1,5-diamino-2-methylimidazol-4-yl)benzonitrile
CID 107936690
6-bromo-2-(2-fluorophenyl)-3,8-dimethylimidazo[1,2-a]pyridine
CID 112680454
6-bromo-2-(4,5-dibromothiophen-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 102844434
2-benzyl-6-bromo-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83170655
6-bromo-2-(4,5-dibromofuran-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83170495
6-bromo-2-(4-chlorothiophen-2-yl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83169941
2-(1,5-diamino-2-phenylimidazol-4-yl)benzonitrile
CID 107936695
13-bromo-9,9,15-trimethyl-8-oxa-11,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaene
CID 83168913

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile?
The IUPAC name of 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile (CID 107936784) is 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile.
What is the SMILES notation for 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile?
The canonical SMILES for 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile is Cc1cc(Br)cn2c(N)c(-c3ccccc3C#N)nc12.
What is the InChIKey of 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile?
The InChIKey is ROJCSSZCSMQIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN4/c1-9-6-11(16)8-20-14(18)13(19-15(9)20)12-5-3-2-4-10(12)7-17/h2-6,8H,18H2,1H3.
What are the key properties of 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile?
2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile has a molecular weight of 327.19 g/mol, XLogP of 3.53, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-6-bromo-8-methylimidazo[1,2-a]pyridin-2-yl)benzonitrile is sourced from PubChem (CID 107936784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).