3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C15H17BrN2 — CID 82124802

IUPAC3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCCc1ccc(-c2nc3n(c2Br)CCCC3)cc1
InChIInChI=1S/C15H17BrN2/c1-2-11-6-8-12(9-7-11)14-15(16)18-10-4-3-5-13(18)17-14/h6-9H,2-5,10H2,1H3
InChIKeyIDICQNFTTVTPRH-UHFFFAOYSA-N
MW305.22 g/mol
LogP4.21
Rot. Bonds2

About 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 82124802) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID82124802
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC Name3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCCc1ccc(-c2nc3n(c2Br)CCCC3)cc1
InChIInChI=1S/C15H17BrN2/c1-2-11-6-8-12(9-7-11)14-15(16)18-10-4-3-5-13(18)17-14/h6-9H,2-5,10H2,1H3
InChIKeyIDICQNFTTVTPRH-UHFFFAOYSA-N
XLogP4.21
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82120368
2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82120163
2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 82123794
3-bromo-2-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 657731
2,3-dibromo-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 10356283
3-bromo-2-chloro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 84699047
2-(4-ethylphenyl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
CID 136995436
3-bromo-2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 83681530
2-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82123432
[2-(3-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanol
CID 116854064
[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 136995684
2-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbonitrile
CID 116854106

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 82124802) is 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is CCc1ccc(-c2nc3n(c2Br)CCCC3)cc1.
What is the InChIKey of 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is IDICQNFTTVTPRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-2-11-6-8-12(9-7-11)14-15(16)18-10-4-3-5-13(18)17-14/h6-9H,2-5,10H2,1H3.
What are the key properties of 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 305.22 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 82124802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).