(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide

C8H12N2O4 — CID 166244618

IUPAC(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESO=C1NC[C@@H](C(=O)NOC2CCC2)O1
InChIInChI=1S/C8H12N2O4/c11-7(6-4-9-8(12)13-6)10-14-5-2-1-3-5/h5-6H,1-4H2,(H,9,12)(H,10,11)/t6-/m0/s1
InChIKeyUKLUJERHNRZOGM-LURJTMIESA-N
MW200.19 g/mol
LogP-0.30
Rot. Bonds3

About (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide

(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide (PubChem CID 166244618) has the molecular formula C8H12N2O4 and a molecular weight of 200.19 g/mol. Its IUPAC name is (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide.

Molecular Properties

Compound Name(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide
PubChem CID166244618
Molecular FormulaC8H12N2O4
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESO=C1NC[C@@H](C(=O)NOC2CCC2)O1
InChIInChI=1S/C8H12N2O4/c11-7(6-4-9-8(12)13-6)10-14-5-2-1-3-5/h5-6H,1-4H2,(H,9,12)(H,10,11)/t6-/m0/s1
InChIKeyUKLUJERHNRZOGM-LURJTMIESA-N
XLogP-0.30
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide?
The IUPAC name of (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide (CID 166244618) is (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide.
What is the SMILES notation for (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide?
The canonical SMILES for (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide is O=C1NC[C@@H](C(=O)NOC2CCC2)O1.
What is the InChIKey of (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide?
The InChIKey is UKLUJERHNRZOGM-LURJTMIESA-N. The full InChI is InChI=1S/C8H12N2O4/c11-7(6-4-9-8(12)13-6)10-14-5-2-1-3-5/h5-6H,1-4H2,(H,9,12)(H,10,11)/t6-/m0/s1.
What are the key properties of (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide?
(5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide has a molecular weight of 200.19 g/mol, XLogP of -0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-N-cyclobutyloxy-2-oxo-1,3-oxazolidine-5-carboxamide is sourced from PubChem (CID 166244618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).