N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine

C13H26N2O3Si — CID 123326595

IUPACN-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine
SMILESC=C[SiH2]OC(ONC(C)=CCC)ONC(C)=CCC
InChIInChI=1S/C13H26N2O3Si/c1-6-9-11(4)14-16-13(18-19-8-3)17-15-12(5)10-7-2/h8-10,13-15H,3,6-7,19H2,1-2,4-5H3
InChIKeyAJQRWOOBESUEID-UHFFFAOYSA-N
MW286.45 g/mol
LogP2.18
Rot. Bonds11

About N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine

N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine (PubChem CID 123326595) has the molecular formula C13H26N2O3Si and a molecular weight of 286.45 g/mol. Its IUPAC name is N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine.

Molecular Properties

Compound NameN-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine
PubChem CID123326595
Molecular FormulaC13H26N2O3Si
Molecular Weight286.45 g/mol
Exact Mass286.17
IUPAC NameN-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine
SMILESC=C[SiH2]OC(ONC(C)=CCC)ONC(C)=CCC
InChIInChI=1S/C13H26N2O3Si/c1-6-9-11(4)14-16-13(18-19-8-3)17-15-12(5)10-7-2/h8-10,13-15H,3,6-7,19H2,1-2,4-5H3
InChIKeyAJQRWOOBESUEID-UHFFFAOYSA-N
XLogP2.18
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.45
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine?
The IUPAC name of N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine (CID 123326595) is N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine.
What is the SMILES notation for N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine?
The canonical SMILES for N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine is C=C[SiH2]OC(ONC(C)=CCC)ONC(C)=CCC.
What is the InChIKey of N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine?
The InChIKey is AJQRWOOBESUEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3Si/c1-6-9-11(4)14-16-13(18-19-8-3)17-15-12(5)10-7-2/h8-10,13-15H,3,6-7,19H2,1-2,4-5H3.
What are the key properties of N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine?
N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine has a molecular weight of 286.45 g/mol, XLogP of 2.18, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethenylsilyloxy-(pent-2-en-2-ylamino)oxymethoxy]pent-2-en-2-amine is sourced from PubChem (CID 123326595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).