5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide

C13H22N2O3 — CID 128994117

IUPAC5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide
SMILESCC(C)[C@H]1OCC[C@@H]1CNC(=O)C1CNC(=O)C1
InChIInChI=1S/C13H22N2O3/c1-8(2)12-9(3-4-18-12)6-15-13(17)10-5-11(16)14-7-10/h8-10,12H,3-7H2,1-2H3,(H,14,16)(H,15,17)/t9-,10?,12-/m1/s1
InChIKeyLRKNDUMABGMNKF-UPCOPKIUSA-N
MW254.33 g/mol
LogP0.30
Rot. Bonds4

About 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide

5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide (PubChem CID 128994117) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide
PubChem CID128994117
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide
SMILESCC(C)[C@H]1OCC[C@@H]1CNC(=O)C1CNC(=O)C1
InChIInChI=1S/C13H22N2O3/c1-8(2)12-9(3-4-18-12)6-15-13(17)10-5-11(16)14-7-10/h8-10,12H,3-7H2,1-2H3,(H,14,16)(H,15,17)/t9-,10?,12-/m1/s1
InChIKeyLRKNDUMABGMNKF-UPCOPKIUSA-N
XLogP0.30
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide with MolForge

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 78991272
N-(3-methoxy-2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 78983025
9-amino-N-[(2-propan-2-yloxolan-3-yl)methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120991798
2-[[(5-oxopyrrolidine-3-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 83193571
N-[[(1S,2R)-2-cyclobutylcyclopropyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 164638984
N-[[(1R,2S)-2-cyclobutylcyclopropyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 128891590
2-amino-N-[(2-propan-2-yloxolan-3-yl)methyl]propanamide
CID 119343855
1-propan-2-yl-3-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]urea
CID 128997473
N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide
CID 83192944
5-oxo-N-(2,2,3-trimethylbutyl)pyrrolidine-3-carboxamide
CID 102610483
N-[[(2S,3R)-2-propan-2-yloxolan-3-yl]methyl]-1H-pyrazole-5-carboxamide
CID 95973460
1-ethyl-N-[(2-propan-2-yloxolan-3-yl)methyl]piperidine-2-carboxamide
CID 71977590

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide (CID 128994117) is 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide is CC(C)[C@H]1OCC[C@@H]1CNC(=O)C1CNC(=O)C1.
What is the InChIKey of 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide?
The InChIKey is LRKNDUMABGMNKF-UPCOPKIUSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-8(2)12-9(3-4-18-12)6-15-13(17)10-5-11(16)14-7-10/h8-10,12H,3-7H2,1-2H3,(H,14,16)(H,15,17)/t9-,10?,12-/m1/s1.
What are the key properties of 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide?
5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 128994117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).