N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

C16H17FN4O3S — CID 15870399

IUPACN-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCCc1nnc(-c2ccc(N3C[C@H](CNC(C)=O)OC3=O)cc2F)s1
InChIInChI=1S/C16H17FN4O3S/c1-3-14-19-20-15(25-14)12-5-4-10(6-13(12)17)21-8-11(24-16(21)23)7-18-9(2)22/h4-6,11H,3,7-8H2,1-2H3,(H,18,22)/t11-/m0/s1
InChIKeyADKGEWPYQMDRHI-NSHDSACASA-N
MW364.40 g/mol
LogP2.37
Rot. Bonds5

About N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 15870399) has the molecular formula C16H17FN4O3S and a molecular weight of 364.40 g/mol. Its IUPAC name is N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID15870399
Molecular FormulaC16H17FN4O3S
Molecular Weight364.40 g/mol
Exact Mass364.10
IUPAC NameN-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCCc1nnc(-c2ccc(N3C[C@H](CNC(C)=O)OC3=O)cc2F)s1
InChIInChI=1S/C16H17FN4O3S/c1-3-14-19-20-15(25-14)12-5-4-10(6-13(12)17)21-8-11(24-16(21)23)7-18-9(2)22/h4-6,11H,3,7-8H2,1-2H3,(H,18,22)/t11-/m0/s1
InChIKeyADKGEWPYQMDRHI-NSHDSACASA-N
XLogP2.37
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-((S)-3-{3-Fluoro-4-[(Z)-2-fluoro-2-(2-methyl-2H-tetrazol-5-yl)-vinyl]-phenyl}-2-oxo-oxazolidin-5-ylmethyl)-acetamide
CID 10177664
N-[[(5S)-3-[4-[5-(aminomethyl)-1,3,4-thiadiazol-2-yl]-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]thioacetamide
CID 3003159
N-[[(5S)-3-[3-fluoro-4-[5-(methylaminomethyl)-1,3,4-thiadiazol-2-yl]phenyl]-2-oxo-oxazolidin-5-yl]methyl]thioacetamide
CID 3003160
Tta4yaz7R5
CID 10404743
5-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-1,3,4-thiadiazole-2-carboxamide
CID 15870397
N-[[(5S)-3-[3-fluoro-4-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 15870398
N-[[(5S)-3-[4-[5-(aminomethyl)-1,3,4-thiadiazol-2-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 15870401
N-[[(5S)-3-[3-fluoro-4-[5-(fluoromethyl)-1,3,4-thiadiazol-2-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 15870403
[5-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-1,3,4-thiadiazol-2-yl]methyl acetate
CID 44354656
N-[[(5S)-3-[3-fluoro-4-(2-oxo-3H-1,3,4-thiadiazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 44354680
N-[[(5S)-3-[3-fluoro-4-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 44354722
2-[5-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 44354881

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (CID 15870399) is N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is CCc1nnc(-c2ccc(N3C[C@H](CNC(C)=O)OC3=O)cc2F)s1.
What is the InChIKey of N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is ADKGEWPYQMDRHI-NSHDSACASA-N. The full InChI is InChI=1S/C16H17FN4O3S/c1-3-14-19-20-15(25-14)12-5-4-10(6-13(12)17)21-8-11(24-16(21)23)7-18-9(2)22/h4-6,11H,3,7-8H2,1-2H3,(H,18,22)/t11-/m0/s1.
What are the key properties of N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 364.40 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-3-[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 15870399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).