5-Silylpent-1-enyl carbamate

C₆H₁₃NO₂Si — CID 151870333

About 5-Silylpent-1-enyl carbamate

5-Silylpent-1-enyl carbamate (PubChem CID 151870333) has the molecular formula C₆H₁₃NO₂Si and a molecular weight of 159.26 g/mol. Its IUPAC name is 5-silylpent-1-enyl carbamate.

Molecular Properties

• Compound Name: 5-Silylpent-1-enyl carbamate
• PubChem CID: 151870333
• Molecular Formula: C₆H₁₃NO₂Si
• Molecular Weight: 159.26 g/mol
• Exact Mass: 159.07
• IUPAC Name: 5-silylpent-1-enyl carbamate
• SMILES: NC(=O)OC=CCCC[SiH3]
• InChI: InChI=1S/C6H13NO2Si/c7-6(8)9-4-2-1-3-5-10/h2,4H,1,3,5H2,10H3,(H2,7,8)
• InChIKey: SMNZLWWDRUQUKN-UHFFFAOYSA-N
• XLogP: 0.16
• TPSA: 52.32 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 4
• Heavy Atoms: 10
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	159.26
LogP ≤ 5	0.16
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-Silylpent-1-enyl carbamate?

The IUPAC name of 5-Silylpent-1-enyl carbamate (CID 151870333) is 5-silylpent-1-enyl carbamate.

What is the SMILES notation for 5-Silylpent-1-enyl carbamate?

The canonical SMILES for 5-Silylpent-1-enyl carbamate is NC(=O)OC=CCCC[SiH3].

What is the InChIKey of 5-Silylpent-1-enyl carbamate?

The InChIKey is SMNZLWWDRUQUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2Si/c7-6(8)9-4-2-1-3-5-10/h2,4H,1,3,5H2,10H3,(H2,7,8).

What are the key properties of 5-Silylpent-1-enyl carbamate?

5-Silylpent-1-enyl carbamate has a molecular weight of 159.26 g/mol, XLogP of 0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 5-Silylpent-1-enyl carbamate is sourced from PubChem (CID 151870333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 151870333 — identifiers, structure, computed properties (public domain)

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