2-(trimethylsilylmethylamino)pent-4-en-1-ol

C9H21NOSi — CID 11106091

IUPAC2-(trimethylsilylmethylamino)pent-4-en-1-ol
SMILESC=CCC(CO)NC[Si](C)(C)C
InChIInChI=1S/C9H21NOSi/c1-5-6-9(7-11)10-8-12(2,3)4/h5,9-11H,1,6-8H2,2-4H3
InChIKeyOFEZWGFSOSPBGT-UHFFFAOYSA-N
MW187.36 g/mol
LogP1.39
Rot. Bonds6

About 2-(trimethylsilylmethylamino)pent-4-en-1-ol

2-(trimethylsilylmethylamino)pent-4-en-1-ol (PubChem CID 11106091) has the molecular formula C9H21NOSi and a molecular weight of 187.36 g/mol. Its IUPAC name is 2-(trimethylsilylmethylamino)pent-4-en-1-ol.

Molecular Properties

Compound Name2-(trimethylsilylmethylamino)pent-4-en-1-ol
PubChem CID11106091
Molecular FormulaC9H21NOSi
Molecular Weight187.36 g/mol
Exact Mass187.14
IUPAC Name2-(trimethylsilylmethylamino)pent-4-en-1-ol
SMILESC=CCC(CO)NC[Si](C)(C)C
InChIInChI=1S/C9H21NOSi/c1-5-6-9(7-11)10-8-12(2,3)4/h5,9-11H,1,6-8H2,2-4H3
InChIKeyOFEZWGFSOSPBGT-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.36
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(trimethylsilylmethylamino)pent-4-en-1-ol?
The IUPAC name of 2-(trimethylsilylmethylamino)pent-4-en-1-ol (CID 11106091) is 2-(trimethylsilylmethylamino)pent-4-en-1-ol.
What is the SMILES notation for 2-(trimethylsilylmethylamino)pent-4-en-1-ol?
The canonical SMILES for 2-(trimethylsilylmethylamino)pent-4-en-1-ol is C=CCC(CO)NC[Si](C)(C)C.
What is the InChIKey of 2-(trimethylsilylmethylamino)pent-4-en-1-ol?
The InChIKey is OFEZWGFSOSPBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NOSi/c1-5-6-9(7-11)10-8-12(2,3)4/h5,9-11H,1,6-8H2,2-4H3.
What are the key properties of 2-(trimethylsilylmethylamino)pent-4-en-1-ol?
2-(trimethylsilylmethylamino)pent-4-en-1-ol has a molecular weight of 187.36 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trimethylsilylmethylamino)pent-4-en-1-ol is sourced from PubChem (CID 11106091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).