1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one

C17H30N2O2Si — CID 67920532

IUPAC1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one
SMILESCC(C)C[Si](C)(C)O[C@@H]1CCCN1C#CCN1CCCC1=O
InChIInChI=1S/C17H30N2O2Si/c1-15(2)14-22(3,4)21-17-9-6-11-19(17)13-7-12-18-10-5-8-16(18)20/h15,17H,5-6,8-12,14H2,1-4H3/t17-/m1/s1
InChIKeyOOCSVUCUOFMEAN-QGZVFWFLSA-N
MW322.53 g/mol
LogP2.87
Rot. Bonds5

About 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one

1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one (PubChem CID 67920532) has the molecular formula C17H30N2O2Si and a molecular weight of 322.53 g/mol. Its IUPAC name is 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one
PubChem CID67920532
Molecular FormulaC17H30N2O2Si
Molecular Weight322.53 g/mol
Exact Mass322.21
IUPAC Name1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one
SMILESCC(C)C[Si](C)(C)O[C@@H]1CCCN1C#CCN1CCCC1=O
InChIInChI=1S/C17H30N2O2Si/c1-15(2)14-22(3,4)21-17-9-6-11-19(17)13-7-12-18-10-5-8-16(18)20/h15,17H,5-6,8-12,14H2,1-4H3/t17-/m1/s1
InChIKeyOOCSVUCUOFMEAN-QGZVFWFLSA-N
XLogP2.87
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.53
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-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

Related Compounds

1-[4-(butan-2-ylamino)but-2-ynyl]pyrrolidin-2-one
CID 21390529
1-[3-[(2S)-pyrrolidin-2-yl]prop-2-ynyl]pyrrolidin-2-one
CID 14756510
1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one
CID 23179439
1-[3-(1,3-thiazol-2-yl)prop-2-ynyl]pyrrolidin-2-one
CID 122242070
1-(3-methyl-2-sulfanylbutyl)pyrrolidin-2-one
CID 141416665
1-[4-(1-methylpyrrolidin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one iodide
CID 45266323
1-[3-[dimethoxy(methyl)silyl]propyl]pyrrolidin-2-one
CID 19753601
1-[2-[diethoxy(methyl)silyl]ethyl]pyrrolidin-2-one
CID 165347947
1-(2-propan-2-yloxyethyl)pyrrolidin-2-one
CID 58735421
1-[4-[3-iodopropyl(methyl)amino]but-2-ynyl]pyrrolidin-2-one;oxalic acid
CID 24845639
1-(4-hydroxy-2-methylbutyl)pyrrolidin-2-one
CID 104550322
3-methyl-2-[(2-oxopyrrolidin-1-yl)methyl]butanoic acid
CID 65220431

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one?
The IUPAC name of 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one (CID 67920532) is 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one?
The canonical SMILES for 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one is CC(C)C[Si](C)(C)O[C@@H]1CCCN1C#CCN1CCCC1=O.
What is the InChIKey of 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one?
The InChIKey is OOCSVUCUOFMEAN-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H30N2O2Si/c1-15(2)14-22(3,4)21-17-9-6-11-19(17)13-7-12-18-10-5-8-16(18)20/h15,17H,5-6,8-12,14H2,1-4H3/t17-/m1/s1.
What are the key properties of 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one?
1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one has a molecular weight of 322.53 g/mol, XLogP of 2.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(2R)-2-[dimethyl(2-methylpropyl)silyl]oxypyrrolidin-1-yl]prop-2-ynyl]pyrrolidin-2-one is sourced from PubChem (CID 67920532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).