1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one

C10H19NOSi — CID 134963572

IUPAC1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one
SMILESC[Si](C)(C)[C@H]1C[C@@H]1N1CCCC1=O
InChIInChI=1S/C10H19NOSi/c1-13(2,3)9-7-8(9)11-6-4-5-10(11)12/h8-9H,4-7H2,1-3H3/t8-,9-/m0/s1
InChIKeyZQWDDTCTGXWPAT-IUCAKERBSA-N
MW197.35 g/mol
LogP2.09
Rot. Bonds2

About 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one

1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one (PubChem CID 134963572) has the molecular formula C10H19NOSi and a molecular weight of 197.35 g/mol. Its IUPAC name is 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one
PubChem CID134963572
Molecular FormulaC10H19NOSi
Molecular Weight197.35 g/mol
Exact Mass197.12
IUPAC Name1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one
SMILESC[Si](C)(C)[C@H]1C[C@@H]1N1CCCC1=O
InChIInChI=1S/C10H19NOSi/c1-13(2,3)9-7-8(9)11-6-4-5-10(11)12/h8-9H,4-7H2,1-3H3/t8-,9-/m0/s1
InChIKeyZQWDDTCTGXWPAT-IUCAKERBSA-N
XLogP2.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.35
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one?
The IUPAC name of 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one (CID 134963572) is 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one?
The canonical SMILES for 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one is C[Si](C)(C)[C@H]1C[C@@H]1N1CCCC1=O.
What is the InChIKey of 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one?
The InChIKey is ZQWDDTCTGXWPAT-IUCAKERBSA-N. The full InChI is InChI=1S/C10H19NOSi/c1-13(2,3)9-7-8(9)11-6-4-5-10(11)12/h8-9H,4-7H2,1-3H3/t8-,9-/m0/s1.
What are the key properties of 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one?
1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one has a molecular weight of 197.35 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S,2S)-2-trimethylsilylcyclopropyl]pyrrolidin-2-one is sourced from PubChem (CID 134963572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).