ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate

C10H10BrN3O2 — CID 82529178

IUPACethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2c(Br)cccn2c1N
InChIInChI=1S/C10H10BrN3O2/c1-2-16-10(15)7-8(12)14-5-3-4-6(11)9(14)13-7/h3-5H,2,12H2,1H3
InChIKeyCDBOQPMASCDUOM-UHFFFAOYSA-N
MW284.11 g/mol
LogP1.86
Rot. Bonds2

About ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate

ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate (PubChem CID 82529178) has the molecular formula C10H10BrN3O2 and a molecular weight of 284.11 g/mol. Its IUPAC name is ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate
PubChem CID82529178
Molecular FormulaC10H10BrN3O2
Molecular Weight284.11 g/mol
Exact Mass283.00
IUPAC Nameethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2c(Br)cccn2c1N
InChIInChI=1S/C10H10BrN3O2/c1-2-16-10(15)7-8(12)14-5-3-4-6(11)9(14)13-7/h3-5H,2,12H2,1H3
InChIKeyCDBOQPMASCDUOM-UHFFFAOYSA-N
XLogP1.86
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.11
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 8-bromo-3-iodoimidazo[1,2-a]pyridine-2-carboxylate
CID 171530837
ethyl 3-amino-8-(hydroxymethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 82355967
ethyl 3-amino-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 82529177
ethyl 8-bromo-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 171530852
ethyl 3-amino-6-bromoimidazo[1,2-a]pyridine-2-carboxylate
CID 82055311
ethyl 8-bromoimidazo[1,2-a]pyridine-2-carboxylate
CID 57360969
ethyl 3-iodo-8-nitroimidazo[1,2-a]pyridine-2-carboxylate
CID 53249809
ethyl 5-amino-1-(2,4-dibromophenyl)-2-ethylimidazole-4-carboxylate
CID 63465967
methyl 3-(aminomethyl)-8-bromoimidazo[1,5-a]pyridine-1-carboxylate
CID 117254883
ethyl 3-bromo-8-[(2,6-dichlorobenzoyl)amino]imidazo[1,2-a]pyridine-2-carboxylate
CID 57020246
ethyl 3-benzoyl-8-bromo-6-methylimidazo[1,2-a]pyridine-2-carboxylate
CID 10971097
methyl 5-amino-1-(2-bromophenyl)-2-ethylimidazole-4-carboxylate
CID 103544311

Frequently Asked Questions

What is the IUPAC name of ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate?
The IUPAC name of ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate (CID 82529178) is ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate.
What is the SMILES notation for ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate?
The canonical SMILES for ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate is CCOC(=O)c1nc2c(Br)cccn2c1N.
What is the InChIKey of ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate?
The InChIKey is CDBOQPMASCDUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O2/c1-2-16-10(15)7-8(12)14-5-3-4-6(11)9(14)13-7/h3-5H,2,12H2,1H3.
What are the key properties of ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate?
ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate has a molecular weight of 284.11 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-amino-8-bromoimidazo[1,2-a]pyridine-2-carboxylate is sourced from PubChem (CID 82529178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).