hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane

C14H29NO4Si — CID 174622660

IUPAChydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane
SMILESC=CCO[Si](O)(OCCC)OCCCN1CCCCC1
InChIInChI=1S/C14H29NO4Si/c1-3-12-17-20(16,18-13-4-2)19-14-8-11-15-9-6-5-7-10-15/h3,16H,1,4-14H2,2H3
InChIKeyXUNSELFSQDGVSK-UHFFFAOYSA-N
MW303.47 g/mol
LogP1.94
Rot. Bonds11

About hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane

hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane (PubChem CID 174622660) has the molecular formula C14H29NO4Si and a molecular weight of 303.47 g/mol. Its IUPAC name is hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane.

Molecular Properties

Compound Namehydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane
PubChem CID174622660
Molecular FormulaC14H29NO4Si
Molecular Weight303.47 g/mol
Exact Mass303.19
IUPAC Namehydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane
SMILESC=CCO[Si](O)(OCCC)OCCCN1CCCCC1
InChIInChI=1S/C14H29NO4Si/c1-3-12-17-20(16,18-13-4-2)19-14-8-11-15-9-6-5-7-10-15/h3,16H,1,4-14H2,2H3
InChIKeyXUNSELFSQDGVSK-UHFFFAOYSA-N
XLogP1.94
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.47
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-pentylpiperidine;prop-1-ene
CID 174775307
1-butylpiperidine;propyl hydrogen sulfate
CID 173126609
1-dodecylazepane
CID 3366129
1-decylpiperidine
CID 4649960
1-octylazonane
CID 20533821
prop-1-ene;1-propylpyrrolidine
CID 143531885
1-hept-6-enylpiperidine
CID 143080853
1-(3-methyliodanuidyloxypropyl)piperidine
CID 162683920
2-methylprop-2-enyl-(3-piperidin-1-ylpropyl)-dipropylsilane
CID 67432048
methanol;1-propylpiperidine
CID 171515121
ethenyl-dimethyl-(3-piperidin-1-ylpropyl)silane
CID 67433761
1-butylpiperidine;hexane;1-hexylpiperidine
CID 156727490

Frequently Asked Questions

What is the IUPAC name of hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane?
The IUPAC name of hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane (CID 174622660) is hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane.
What is the SMILES notation for hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane?
The canonical SMILES for hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane is C=CCO[Si](O)(OCCC)OCCCN1CCCCC1.
What is the InChIKey of hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane?
The InChIKey is XUNSELFSQDGVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO4Si/c1-3-12-17-20(16,18-13-4-2)19-14-8-11-15-9-6-5-7-10-15/h3,16H,1,4-14H2,2H3.
What are the key properties of hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane?
hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane has a molecular weight of 303.47 g/mol, XLogP of 1.94, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(3-piperidin-1-ylpropoxy)-prop-2-enoxy-propoxysilane is sourced from PubChem (CID 174622660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).