N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

C27H24N4O5 — CID 57040200

IUPACN-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc(C(=O)c3cnc4c(OCc5ccccc5)cccn34)cc2)C(=O)O1
InChIInChI=1S/C27H24N4O5/c1-18(32)28-14-22-16-31(27(34)36-22)21-11-9-20(10-12-21)25(33)23-15-29-26-24(8-5-13-30(23)26)35-17-19-6-3-2-4-7-19/h2-13,15,22H,14,16-17H2,1H3,(H,28,32)/t22-/m0/s1
InChIKeyHYCULGDJNCLMJA-QFIPXVFZSA-N
MW484.51 g/mol
LogP3.61
Rot. Bonds8

About N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 57040200) has the molecular formula C27H24N4O5 and a molecular weight of 484.51 g/mol. Its IUPAC name is N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID57040200
Molecular FormulaC27H24N4O5
Molecular Weight484.51 g/mol
Exact Mass484.17
IUPAC NameN-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc(C(=O)c3cnc4c(OCc5ccccc5)cccn34)cc2)C(=O)O1
InChIInChI=1S/C27H24N4O5/c1-18(32)28-14-22-16-31(27(34)36-22)21-11-9-20(10-12-21)25(33)23-15-29-26-24(8-5-13-30(23)26)35-17-19-6-3-2-4-7-19/h2-13,15,22H,14,16-17H2,1H3,(H,28,32)/t22-/m0/s1
InChIKeyHYCULGDJNCLMJA-QFIPXVFZSA-N
XLogP3.61
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.51
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[[(5S)-3-[4-(6-methylsulfanylimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57194150
N-[[(5S)-3-(3-nitro-4-phenylmethoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57028429
N-[[(5S)-3-[4-[6-(methylsulfamoyl)imidazo[1,2-a]pyridine-3-carbonyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 70288852
N-[[(5S)-2-oxo-3-[4-(1H-pyrrole-2-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57081651
ethyl 4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoate
CID 14809103
but-2-yne;ethane;N-[[(5S)-2-oxo-3-phenyl-1,3-oxazolidin-5-yl]methyl]acetamide
CID 90796180
N-[[(5R)-3-[4-(hydroxymethyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 54472628
benzyl N-[[3-(4-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate
CID 16920837
N-[[3-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 68698825
N-[[(5S)-2-oxo-3-(4-pyridin-3-ylphenyl)-1,3-oxazolidin-5-yl]methyl]acetamide
CID 14987829
N-[(3-naphthalen-2-yl-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide
CID 19012489
(5R)-5-(hydroxymethyl)-3-(4-phenylmethoxyphenyl)-1,3-oxazolidin-2-one
CID 11109337

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (CID 57040200) is N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NC[C@H]1CN(c2ccc(C(=O)c3cnc4c(OCc5ccccc5)cccn34)cc2)C(=O)O1.
What is the InChIKey of N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is HYCULGDJNCLMJA-QFIPXVFZSA-N. The full InChI is InChI=1S/C27H24N4O5/c1-18(32)28-14-22-16-31(27(34)36-22)21-11-9-20(10-12-21)25(33)23-15-29-26-24(8-5-13-30(23)26)35-17-19-6-3-2-4-7-19/h2-13,15,22H,14,16-17H2,1H3,(H,28,32)/t22-/m0/s1.
What are the key properties of N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 484.51 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-2-oxo-3-[4-(8-phenylmethoxyimidazo[1,2-a]pyridine-3-carbonyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 57040200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).