(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C14H15BrN2 — CID 129462570

IUPAC(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCCc2nc(-c3ccccc3Br)cn21
InChIInChI=1S/C14H15BrN2/c1-10-5-4-8-14-16-13(9-17(10)14)11-6-2-3-7-12(11)15/h2-3,6-7,9-10H,4-5,8H2,1H3/t10-/m0/s1
InChIKeyJDRAZDKVDDZCDL-JTQLQIEISA-N
MW291.19 g/mol
LogP4.21
Rot. Bonds1

About (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 129462570) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID129462570
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCCc2nc(-c3ccccc3Br)cn21
InChIInChI=1S/C14H15BrN2/c1-10-5-4-8-14-16-13(9-17(10)14)11-6-2-3-7-12(11)15/h2-3,6-7,9-10H,4-5,8H2,1H3/t10-/m0/s1
InChIKeyJDRAZDKVDDZCDL-JTQLQIEISA-N
XLogP4.21
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 129462570) is (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is C[C@H]1CCCc2nc(-c3ccccc3Br)cn21.
What is the InChIKey of (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is JDRAZDKVDDZCDL-JTQLQIEISA-N. The full InChI is InChI=1S/C14H15BrN2/c1-10-5-4-8-14-16-13(9-17(10)14)11-6-2-3-7-12(11)15/h2-3,6-7,9-10H,4-5,8H2,1H3/t10-/m0/s1.
What are the key properties of (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
(5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 291.19 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2-(2-bromophenyl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 129462570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).