N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

C16H17N3O6S — CID 67691921

IUPACN-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2cccc3ccc(=O)n(S(C)(=O)=O)c23)C(=O)O1
InChIInChI=1S/C16H17N3O6S/c1-10(20)17-8-12-9-18(16(22)25-12)13-5-3-4-11-6-7-14(21)19(15(11)13)26(2,23)24/h3-7,12H,8-9H2,1-2H3,(H,17,20)/t12-/m0/s1
InChIKeyFCAPWGXGWQPFHM-LBPRGKRZSA-N
MW379.39 g/mol
LogP0.27
Rot. Bonds4

About N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 67691921) has the molecular formula C16H17N3O6S and a molecular weight of 379.39 g/mol. Its IUPAC name is N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID67691921
Molecular FormulaC16H17N3O6S
Molecular Weight379.39 g/mol
Exact Mass379.08
IUPAC NameN-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2cccc3ccc(=O)n(S(C)(=O)=O)c23)C(=O)O1
InChIInChI=1S/C16H17N3O6S/c1-10(20)17-8-12-9-18(16(22)25-12)13-5-3-4-11-6-7-14(21)19(15(11)13)26(2,23)24/h3-7,12H,8-9H2,1-2H3,(H,17,20)/t12-/m0/s1
InChIKeyFCAPWGXGWQPFHM-LBPRGKRZSA-N
XLogP0.27
TPSA114.78 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.39
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide with MolForge

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Related Compounds

8-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-N-(dimethylcarbamoyl)-2-oxoquinoline-1-carboxamide
CID 67691481
N-[(3-naphthalen-2-yl-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide
CID 19012489
N-[(2-oxo-3-pyridin-2-yl-1,3-oxazolidin-5-yl)methyl]acetamide
CID 10082798
N-[[(5S)-3-(6-methylthieno[2,3-b]pyridin-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 67695879
N-[[3-(3-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10110385
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
N-[[3-(3,4-dimethylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 20666078
N-[[3-[4-(4-formylphenyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 14987724
N-[[(5R)-3-[3-fluoro-4-[2-fluoro-4-[(5R)-5-(methanesulfonamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10392453
N-[[(5S)-2-oxo-3-quinolin-6-yl-1,3-oxazolidin-5-yl]methyl]acetamide;hydrochloride
CID 67664955
N-[[(5R)-3-[4-(1-hydroxyethyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 151762391

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (CID 67691921) is N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NC[C@H]1CN(c2cccc3ccc(=O)n(S(C)(=O)=O)c23)C(=O)O1.
What is the InChIKey of N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is FCAPWGXGWQPFHM-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H17N3O6S/c1-10(20)17-8-12-9-18(16(22)25-12)13-5-3-4-11-6-7-14(21)19(15(11)13)26(2,23)24/h3-7,12H,8-9H2,1-2H3,(H,17,20)/t12-/m0/s1.
What are the key properties of N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 379.39 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-3-(1-methylsulfonyl-2-oxoquinolin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 67691921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).