2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one

C10H21NO2 — CID 90914673

IUPAC2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one
SMILESCC(C)(C)C.CC[C@@H]1COC(=O)N1
InChIInChI=1S/C5H9NO2.C5H12/c1-2-4-3-8-5(7)6-4;1-5(2,3)4/h4H,2-3H2,1H3,(H,6,7);1-4H3/t4-;/m1./s1
InChIKeyKZJOQCVRCWONBS-PGMHMLKASA-N
MW187.28 g/mol
LogP2.56
Rot. Bonds1

About 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one

2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one (PubChem CID 90914673) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one
PubChem CID90914673
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one
SMILESCC(C)(C)C.CC[C@@H]1COC(=O)N1
InChIInChI=1S/C5H9NO2.C5H12/c1-2-4-3-8-5(7)6-4;1-5(2,3)4/h4H,2-3H2,1H3,(H,6,7);1-4H3/t4-;/m1./s1
InChIKeyKZJOQCVRCWONBS-PGMHMLKASA-N
XLogP2.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one?
The IUPAC name of 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one (CID 90914673) is 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one?
The canonical SMILES for 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one is CC(C)(C)C.CC[C@@H]1COC(=O)N1.
What is the InChIKey of 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one?
The InChIKey is KZJOQCVRCWONBS-PGMHMLKASA-N. The full InChI is InChI=1S/C5H9NO2.C5H12/c1-2-4-3-8-5(7)6-4;1-5(2,3)4/h4H,2-3H2,1H3,(H,6,7);1-4H3/t4-;/m1./s1.
What are the key properties of 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one?
2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one has a molecular weight of 187.28 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropane;(4R)-4-ethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 90914673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).