N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine

C13H26N2O2Si — CID 91415245

IUPACN-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine
SMILESC=C[Si](C)(ONC(C)=CCC)ONC(C)=CCC
InChIInChI=1S/C13H26N2O2Si/c1-7-10-12(4)14-16-18(6,9-3)17-15-13(5)11-8-2/h9-11,14-15H,3,7-8H2,1-2,4-6H3
InChIKeyYQMNBTAWBSPDQZ-UHFFFAOYSA-N
MW270.45 g/mol
LogP3.45
Rot. Bonds9

About N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine

N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine (PubChem CID 91415245) has the molecular formula C13H26N2O2Si and a molecular weight of 270.45 g/mol. Its IUPAC name is N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine.

Molecular Properties

Compound NameN-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine
PubChem CID91415245
Molecular FormulaC13H26N2O2Si
Molecular Weight270.45 g/mol
Exact Mass270.18
IUPAC NameN-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine
SMILESC=C[Si](C)(ONC(C)=CCC)ONC(C)=CCC
InChIInChI=1S/C13H26N2O2Si/c1-7-10-12(4)14-16-18(6,9-3)17-15-13(5)11-8-2/h9-11,14-15H,3,7-8H2,1-2,4-6H3
InChIKeyYQMNBTAWBSPDQZ-UHFFFAOYSA-N
XLogP3.45
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.45
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine?
The IUPAC name of N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine (CID 91415245) is N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine.
What is the SMILES notation for N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine?
The canonical SMILES for N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine is C=C[Si](C)(ONC(C)=CCC)ONC(C)=CCC.
What is the InChIKey of N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine?
The InChIKey is YQMNBTAWBSPDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2Si/c1-7-10-12(4)14-16-18(6,9-3)17-15-13(5)11-8-2/h9-11,14-15H,3,7-8H2,1-2,4-6H3.
What are the key properties of N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine?
N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine has a molecular weight of 270.45 g/mol, XLogP of 3.45, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethenyl-methyl-(pent-2-en-2-ylamino)oxysilyl]oxypent-2-en-2-amine is sourced from PubChem (CID 91415245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).