N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide

C9H16N2O3 — CID 170088309

IUPACN-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide
SMILESCCN1OC[C@H](NC(=O)C(C)C)C1=O
InChIInChI=1S/C9H16N2O3/c1-4-11-9(13)7(5-14-11)10-8(12)6(2)3/h6-7H,4-5H2,1-3H3,(H,10,12)/t7-/m0/s1
InChIKeyCASJDIKLBJDONI-ZETCQYMHSA-N
MW200.24 g/mol
LogP-0.08
Rot. Bonds3

About N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide

N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide (PubChem CID 170088309) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide
PubChem CID170088309
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC NameN-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide
SMILESCCN1OC[C@H](NC(=O)C(C)C)C1=O
InChIInChI=1S/C9H16N2O3/c1-4-11-9(13)7(5-14-11)10-8(12)6(2)3/h6-7H,4-5H2,1-3H3,(H,10,12)/t7-/m0/s1
InChIKeyCASJDIKLBJDONI-ZETCQYMHSA-N
XLogP-0.08
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?
The IUPAC name of N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide (CID 170088309) is N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide.
What is the SMILES notation for N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?
The canonical SMILES for N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide is CCN1OC[C@H](NC(=O)C(C)C)C1=O.
What is the InChIKey of N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?
The InChIKey is CASJDIKLBJDONI-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-4-11-9(13)7(5-14-11)10-8(12)6(2)3/h6-7H,4-5H2,1-3H3,(H,10,12)/t7-/m0/s1.
What are the key properties of N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?
N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide has a molecular weight of 200.24 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide is sourced from PubChem (CID 170088309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).