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

C17H20N4O4 — CID 72860834

IUPACN-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
SMILESCc1nc(CCN(C)C(=O)CN2C(=O)OC[C@@H]2c2ccccc2)no1
InChIInChI=1S/C17H20N4O4/c1-12-18-15(19-25-12)8-9-20(2)16(22)10-21-14(11-24-17(21)23)13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3/t14-/m1/s1
InChIKeyAMVAHNVWFDLHMP-CQSZACIVSA-N
MW344.37 g/mol
LogP1.57
Rot. Bonds6

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

N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide (PubChem CID 72860834) has the molecular formula C17H20N4O4 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
PubChem CID72860834
Molecular FormulaC17H20N4O4
Molecular Weight344.37 g/mol
Exact Mass344.15
IUPAC NameN-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
SMILESCc1nc(CCN(C)C(=O)CN2C(=O)OC[C@@H]2c2ccccc2)no1
InChIInChI=1S/C17H20N4O4/c1-12-18-15(19-25-12)8-9-20(2)16(22)10-21-14(11-24-17(21)23)13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3/t14-/m1/s1
InChIKeyAMVAHNVWFDLHMP-CQSZACIVSA-N
XLogP1.57
TPSA88.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The IUPAC name of N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide (CID 72860834) is N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide.
What is the SMILES notation for N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The canonical SMILES for N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide is Cc1nc(CCN(C)C(=O)CN2C(=O)OC[C@@H]2c2ccccc2)no1.
What is the InChIKey of N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The InChIKey is AMVAHNVWFDLHMP-CQSZACIVSA-N. The full InChI is InChI=1S/C17H20N4O4/c1-12-18-15(19-25-12)8-9-20(2)16(22)10-21-14(11-24-17(21)23)13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3/t14-/m1/s1.
What are the key properties of N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide has a molecular weight of 344.37 g/mol, XLogP of 1.57, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide is sourced from PubChem (CID 72860834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).