methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate

C11H21NO3 — CID 169131315

IUPACmethyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate
SMILESCOCC(C)N1CCC[C@]1(C)C(=O)OC
InChIInChI=1S/C11H21NO3/c1-9(8-14-3)12-7-5-6-11(12,2)10(13)15-4/h9H,5-8H2,1-4H3/t9?,11-/m1/s1
InChIKeyMNDDTJSWIFIMHA-HCCKASOXSA-N
MW215.29 g/mol
LogP1.05
Rot. Bonds4

About methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate

methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate (PubChem CID 169131315) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate.

Molecular Properties

Compound Namemethyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate
PubChem CID169131315
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Namemethyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate
SMILESCOCC(C)N1CCC[C@]1(C)C(=O)OC
InChIInChI=1S/C11H21NO3/c1-9(8-14-3)12-7-5-6-11(12,2)10(13)15-4/h9H,5-8H2,1-4H3/t9?,11-/m1/s1
InChIKeyMNDDTJSWIFIMHA-HCCKASOXSA-N
XLogP1.05
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate 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 methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate?
The IUPAC name of methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate (CID 169131315) is methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate.
What is the SMILES notation for methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate?
The canonical SMILES for methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate is COCC(C)N1CCC[C@]1(C)C(=O)OC.
What is the InChIKey of methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate?
The InChIKey is MNDDTJSWIFIMHA-HCCKASOXSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(8-14-3)12-7-5-6-11(12,2)10(13)15-4/h9H,5-8H2,1-4H3/t9?,11-/m1/s1.
What are the key properties of methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate?
methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate has a molecular weight of 215.29 g/mol, XLogP of 1.05, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-1-(1-methoxypropan-2-yl)-2-methylpyrrolidine-2-carboxylate is sourced from PubChem (CID 169131315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).