1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone

C12H13N3O3 — CID 112736827

IUPAC1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
SMILESO=C(Cc1cn2ccccc2n1)N1C[C@H](O)CO1
InChIInChI=1S/C12H13N3O3/c16-10-7-15(18-8-10)12(17)5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,16H,5,7-8H2/t10-/m0/s1
InChIKeyDZHKSLVJFFYBPT-JTQLQIEISA-N
MW247.25 g/mol
LogP0.01
Rot. Bonds2

About 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone

1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone (PubChem CID 112736827) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone.

Molecular Properties

Compound Name1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
PubChem CID112736827
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC Name1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
SMILESO=C(Cc1cn2ccccc2n1)N1C[C@H](O)CO1
InChIInChI=1S/C12H13N3O3/c16-10-7-15(18-8-10)12(17)5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,16H,5,7-8H2/t10-/m0/s1
InChIKeyDZHKSLVJFFYBPT-JTQLQIEISA-N
XLogP0.01
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone with MolForge

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Related Compounds

1-(3-hydroxyazetidin-1-yl)-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 63106394
(4-hydroxy-1,2-oxazolidin-2-yl)-imidazo[1,2-a]pyridin-2-ylmethanone
CID 112736664
1-(3-hydroxy-4-methylpiperidin-1-yl)-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 103900447
1-[(2S,4S)-2-(3-fluorophenyl)-4-hydroxypyrrolidin-1-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 100720151
2-imidazo[1,2-a]pyridin-2-yl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 39299976
1-(3-ethyl-4-morpholin-4-ylpyrrolidin-1-yl)-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 71872087
2-imidazo[1,2-a]pyridin-2-yl-1-[(3S)-3-methyl-4-methylsulfonylpiperazin-1-yl]ethanone
CID 146126092
1-cyclopropyl-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 79417170
1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-3-ol
CID 62918360
1-[(2R)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 97018134
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone
CID 119644297
3-(2-imidazo[1,2-a]pyridin-2-ylacetyl)-2-methyl-1,3-thiazolidine-4-carboxylic acid
CID 63792301

Frequently Asked Questions

What is the IUPAC name of 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone?
The IUPAC name of 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone (CID 112736827) is 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone.
What is the SMILES notation for 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone?
The canonical SMILES for 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone is O=C(Cc1cn2ccccc2n1)N1C[C@H](O)CO1.
What is the InChIKey of 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone?
The InChIKey is DZHKSLVJFFYBPT-JTQLQIEISA-N. The full InChI is InChI=1S/C12H13N3O3/c16-10-7-15(18-8-10)12(17)5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,16H,5,7-8H2/t10-/m0/s1.
What are the key properties of 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone?
1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone has a molecular weight of 247.25 g/mol, XLogP of 0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-2-imidazo[1,2-a]pyridin-2-ylethanone is sourced from PubChem (CID 112736827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).