azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane

C12H25NSi — CID 67433680

IUPACazepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane
SMILESC=C(C)[Si](C)(C)CN1CCCCCC1
InChIInChI=1S/C12H25NSi/c1-12(2)14(3,4)11-13-9-7-5-6-8-10-13/h1,5-11H2,2-4H3
InChIKeyLSGIAMNXSQOLIQ-UHFFFAOYSA-N
MW211.42 g/mol
LogP3.23
Rot. Bonds3

About azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane

azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane (PubChem CID 67433680) has the molecular formula C12H25NSi and a molecular weight of 211.42 g/mol. Its IUPAC name is azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane.

Molecular Properties

Compound Nameazepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane
PubChem CID67433680
Molecular FormulaC12H25NSi
Molecular Weight211.42 g/mol
Exact Mass211.18
IUPAC Nameazepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane
SMILESC=C(C)[Si](C)(C)CN1CCCCCC1
InChIInChI=1S/C12H25NSi/c1-12(2)14(3,4)11-13-9-7-5-6-8-10-13/h1,5-11H2,2-4H3
InChIKeyLSGIAMNXSQOLIQ-UHFFFAOYSA-N
XLogP3.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.42
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

azocan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane
CID 67434157
piperidin-1-ylmethyl-prop-1-en-2-yl-dipropylsilane
CID 67433262
ethenyl-methyl-bis(piperidin-1-ylmethyl)silane
CID 158052989
ethenyl-dimethyl-(piperidin-1-ylmethyl)silane
CID 67432577
azocan-1-ylmethyl-(2-methylprop-2-enyl)-dipropylsilane
CID 67432937
dimethoxy-methyl-(piperidin-1-ylmethyl)silane
CID 67433480
dimethyl-prop-2-enyl-(pyrrolidin-1-ylmethyl)silane
CID 14248532
1-(3-methyl-2-methylidenebut-3-enyl)pyrrolidine
CID 153374004
[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane
CID 67433286
2-methylprop-2-enoic acid;2-piperidin-1-ylacetic acid
CID 174941495
(E)-2-methyl-4-piperidin-1-ylbut-2-en-1-ol
CID 14658329
1-prop-1-en-2-ylpiperidine
CID 12570653

Frequently Asked Questions

What is the IUPAC name of azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane?
The IUPAC name of azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane (CID 67433680) is azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane.
What is the SMILES notation for azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane?
The canonical SMILES for azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane is C=C(C)[Si](C)(C)CN1CCCCCC1.
What is the InChIKey of azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane?
The InChIKey is LSGIAMNXSQOLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NSi/c1-12(2)14(3,4)11-13-9-7-5-6-8-10-13/h1,5-11H2,2-4H3.
What are the key properties of azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane?
azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane has a molecular weight of 211.42 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azepan-1-ylmethyl-dimethyl-prop-1-en-2-ylsilane is sourced from PubChem (CID 67433680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).