3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine

C18H19BrN4 — CID 159450021

IUPAC3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine
SMILESCCc1cn2ccccc2n1.CCc1nc2ccccn2c1Br
InChIInChI=1S/C9H9BrN2.C9H10N2/c1-2-7-9(10)12-6-4-3-5-8(12)11-7;1-2-8-7-11-6-4-3-5-9(11)10-8/h3-6H,2H2,1H3;3-7H,2H2,1H3
InChIKeyLTGFTJSHHYJECD-UHFFFAOYSA-N
MW371.28 g/mol
LogP4.56
Rot. Bonds2

About 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine

3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine (PubChem CID 159450021) has the molecular formula C18H19BrN4 and a molecular weight of 371.28 g/mol. Its IUPAC name is 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine
PubChem CID159450021
Molecular FormulaC18H19BrN4
Molecular Weight371.28 g/mol
Exact Mass370.08
IUPAC Name3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine
SMILESCCc1cn2ccccc2n1.CCc1nc2ccccn2c1Br
InChIInChI=1S/C9H9BrN2.C9H10N2/c1-2-7-9(10)12-6-4-3-5-8(12)11-7;1-2-8-7-11-6-4-3-5-9(11)10-8/h3-6H,2H2,1H3;3-7H,2H2,1H3
InChIKeyLTGFTJSHHYJECD-UHFFFAOYSA-N
XLogP4.56
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.28
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
2-ethylimidazo[1,2-a]pyridin-3-amine
CID 63617913
imidazo[1,2-a]pyridin-2-ylmethylazanium
CID 7012186
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine
CID 59380864
2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
CID 1184382
2-[(2-methylphenyl)methylsulfanylmethyl]imidazo[1,2-a]pyridine
CID 84603021
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 28602482
2-[chloro(dideuterio)methyl]imidazo[1,2-a]pyridine;hydrochloride
CID 164900290
1-(2-ethylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 76849304

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine (CID 159450021) is 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine is CCc1cn2ccccc2n1.CCc1nc2ccccn2c1Br.
What is the InChIKey of 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine?
The InChIKey is LTGFTJSHHYJECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2.C9H10N2/c1-2-7-9(10)12-6-4-3-5-8(12)11-7;1-2-8-7-11-6-4-3-5-9(11)10-8/h3-6H,2H2,1H3;3-7H,2H2,1H3.
What are the key properties of 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine?
3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine has a molecular weight of 371.28 g/mol, XLogP of 4.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine is sourced from PubChem (CID 159450021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).