methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate

C11H18N2O3 — CID 99777253

IUPACmethyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate
SMILESCOC(=O)[C@H](N[C@@H]1CCN(C)C1=O)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13-6-5-8(10(13)14)12-9(7-3-4-7)11(15)16-2/h7-9,12H,3-6H2,1-2H3/t8-,9-/m1/s1
InChIKeyHFRGRWXTEHJKFY-RKDXNWHRSA-N
MW226.28 g/mol
LogP-0.24
Rot. Bonds4

About methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate

methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate (PubChem CID 99777253) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate.

Molecular Properties

Compound Namemethyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate
PubChem CID99777253
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Namemethyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate
SMILESCOC(=O)[C@H](N[C@@H]1CCN(C)C1=O)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13-6-5-8(10(13)14)12-9(7-3-4-7)11(15)16-2/h7-9,12H,3-6H2,1-2H3/t8-,9-/m1/s1
InChIKeyHFRGRWXTEHJKFY-RKDXNWHRSA-N
XLogP-0.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate with MolForge

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

Launch Full Analysis

Related Compounds

methyl (2S)-2-[[(3S)-1-(3-chlorophenyl)-2-oxopyrrolidin-3-yl]amino]-2-cyclopropylacetate
CID 125137384
methyl 2-cyclopropyl-2-(cyclopropylamino)acetate
CID 61310174
2-methoxy-N-(1-methyl-2-oxopyrrolidin-3-yl)propanamide
CID 103681220
3-[[(1S)-1-cyclohexylethyl]amino]-1-methylpyrrolidin-2-one
CID 81384940
methyl 2-cyclopropyl-2-(oxetan-3-ylamino)acetate
CID 103256848
(3S)-1-methyl-3-(methylamino)pyrrolidin-2-one
CID 94236128
methyl (E)-3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]prop-2-enoate
CID 106257568
3-[(3-hydroxy-4-methoxybutyl)amino]-1-methylpyrrolidin-2-one
CID 106246688
2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]hexanoic acid
CID 106257611
3-[[cyclopropyl(thiophen-2-yl)methyl]amino]-1-methylpyrrolidin-2-one
CID 106253082
methyl 2-cyclopropyl-2-[(2,2-dimethylcyclopropyl)amino]acetate
CID 103244098
3-[1-(1-ethylpiperidin-4-yl)ethylamino]-1-methylpyrrolidin-2-one
CID 106252496

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate?
The IUPAC name of methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate (CID 99777253) is methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate.
What is the SMILES notation for methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate?
The canonical SMILES for methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate is COC(=O)[C@H](N[C@@H]1CCN(C)C1=O)C1CC1.
What is the InChIKey of methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate?
The InChIKey is HFRGRWXTEHJKFY-RKDXNWHRSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-13-6-5-8(10(13)14)12-9(7-3-4-7)11(15)16-2/h7-9,12H,3-6H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate?
methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate has a molecular weight of 226.28 g/mol, XLogP of -0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate is sourced from PubChem (CID 99777253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).