N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine

C12H21NSi — CID 173311259

IUPACN-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine
SMILESCN(C)[Si](C)(C)C1C=CC/C=C\C=C/1
InChIInChI=1S/C12H21NSi/c1-13(2)14(3,4)12-10-8-6-5-7-9-11-12/h5-6,8-12H,7H2,1-4H3/b6-5-,10-8-,11-9?
InChIKeyFOFYMPWEOGVTPX-ONFZRIIRSA-N
MW207.39 g/mol
LogP3.20
Rot. Bonds2

About N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine

N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine (PubChem CID 173311259) has the molecular formula C12H21NSi and a molecular weight of 207.39 g/mol. Its IUPAC name is N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine
PubChem CID173311259
Molecular FormulaC12H21NSi
Molecular Weight207.39 g/mol
Exact Mass207.14
IUPAC NameN-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine
SMILESCN(C)[Si](C)(C)C1C=CC/C=C\C=C/1
InChIInChI=1S/C12H21NSi/c1-13(2)14(3,4)12-10-8-6-5-7-9-11-12/h5-6,8-12H,7H2,1-4H3/b6-5-,10-8-,11-9?
InChIKeyFOFYMPWEOGVTPX-ONFZRIIRSA-N
XLogP3.20
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.39
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine?
The IUPAC name of N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine (CID 173311259) is N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine.
What is the SMILES notation for N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine?
The canonical SMILES for N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine is CN(C)[Si](C)(C)C1C=CC/C=C\C=C/1.
What is the InChIKey of N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine?
The InChIKey is FOFYMPWEOGVTPX-ONFZRIIRSA-N. The full InChI is InChI=1S/C12H21NSi/c1-13(2)14(3,4)12-10-8-6-5-7-9-11-12/h5-6,8-12H,7H2,1-4H3/b6-5-,10-8-,11-9?.
What are the key properties of N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine?
N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine has a molecular weight of 207.39 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2Z,4Z)-cycloocta-2,4,7-trien-1-yl]-dimethylsilyl]-N-methylmethanamine is sourced from PubChem (CID 173311259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).