1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione

C14H25NO2Si — CID 10880073

IUPAC1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione
SMILESC=C(C[C@@H](C)N1C(=O)CCCC1=O)C[Si](C)(C)C
InChIInChI=1S/C14H25NO2Si/c1-11(10-18(3,4)5)9-12(2)15-13(16)7-6-8-14(15)17/h12H,1,6-10H2,2-5H3/t12-/m1/s1
InChIKeyZSZQLMKURYBYPB-GFCCVEGCSA-N
MW267.44 g/mol
LogP3.20
Rot. Bonds5

About 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione

1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione (PubChem CID 10880073) has the molecular formula C14H25NO2Si and a molecular weight of 267.44 g/mol. Its IUPAC name is 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione.

Molecular Properties

Compound Name1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione
PubChem CID10880073
Molecular FormulaC14H25NO2Si
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione
SMILESC=C(C[C@@H](C)N1C(=O)CCCC1=O)C[Si](C)(C)C
InChIInChI=1S/C14H25NO2Si/c1-11(10-18(3,4)5)9-12(2)15-13(16)7-6-8-14(15)17/h12H,1,6-10H2,2-5H3/t12-/m1/s1
InChIKeyZSZQLMKURYBYPB-GFCCVEGCSA-N
XLogP3.20
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione?
The IUPAC name of 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione (CID 10880073) is 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione.
What is the SMILES notation for 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione?
The canonical SMILES for 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione is C=C(C[C@@H](C)N1C(=O)CCCC1=O)C[Si](C)(C)C.
What is the InChIKey of 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione?
The InChIKey is ZSZQLMKURYBYPB-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H25NO2Si/c1-11(10-18(3,4)5)9-12(2)15-13(16)7-6-8-14(15)17/h12H,1,6-10H2,2-5H3/t12-/m1/s1.
What are the key properties of 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione?
1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione has a molecular weight of 267.44 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-4-(trimethylsilylmethyl)pent-4-en-2-yl]piperidine-2,6-dione is sourced from PubChem (CID 10880073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).