propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate

C10H16O4 — CID 101150640

IUPACpropan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate
SMILESCC(C)OC(=O)[C@H](C)[C@H]1OCCC1=O
InChIInChI=1S/C10H16O4/c1-6(2)14-10(12)7(3)9-8(11)4-5-13-9/h6-7,9H,4-5H2,1-3H3/t7-,9-/m1/s1
InChIKeyBLIVUPKLSSKHHA-VXNVDRBHSA-N
MW200.23 g/mol
LogP0.93
Rot. Bonds3

About propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate

propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate (PubChem CID 101150640) has the molecular formula C10H16O4 and a molecular weight of 200.23 g/mol. Its IUPAC name is propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate.

Molecular Properties

Compound Namepropan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate
PubChem CID101150640
Molecular FormulaC10H16O4
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Namepropan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate
SMILESCC(C)OC(=O)[C@H](C)[C@H]1OCCC1=O
InChIInChI=1S/C10H16O4/c1-6(2)14-10(12)7(3)9-8(11)4-5-13-9/h6-7,9H,4-5H2,1-3H3/t7-,9-/m1/s1
InChIKeyBLIVUPKLSSKHHA-VXNVDRBHSA-N
XLogP0.93
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate 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 propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate?
The IUPAC name of propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate (CID 101150640) is propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate.
What is the SMILES notation for propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate?
The canonical SMILES for propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate is CC(C)OC(=O)[C@H](C)[C@H]1OCCC1=O.
What is the InChIKey of propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate?
The InChIKey is BLIVUPKLSSKHHA-VXNVDRBHSA-N. The full InChI is InChI=1S/C10H16O4/c1-6(2)14-10(12)7(3)9-8(11)4-5-13-9/h6-7,9H,4-5H2,1-3H3/t7-,9-/m1/s1.
What are the key properties of propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate?
propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate has a molecular weight of 200.23 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl (2R)-2-[(2R)-3-oxooxolan-2-yl]propanoate is sourced from PubChem (CID 101150640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).