N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine

C12H24N2O2Si — CID 123621595

IUPACN-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine
SMILESC=C[SiH](ONC(C)=C(C)C)ONC(C)=C(C)C
InChIInChI=1S/C12H24N2O2Si/c1-8-17(15-13-11(6)9(2)3)16-14-12(7)10(4)5/h8,13-14,17H,1H2,2-7H3
InChIKeyOHYCNJVXUFLACK-UHFFFAOYSA-N
MW256.42 g/mol
LogP2.60
Rot. Bonds7

About N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine

N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine (PubChem CID 123621595) has the molecular formula C12H24N2O2Si and a molecular weight of 256.42 g/mol. Its IUPAC name is N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine.

Molecular Properties

Compound NameN-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine
PubChem CID123621595
Molecular FormulaC12H24N2O2Si
Molecular Weight256.42 g/mol
Exact Mass256.16
IUPAC NameN-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine
SMILESC=C[SiH](ONC(C)=C(C)C)ONC(C)=C(C)C
InChIInChI=1S/C12H24N2O2Si/c1-8-17(15-13-11(6)9(2)3)16-14-12(7)10(4)5/h8,13-14,17H,1H2,2-7H3
InChIKeyOHYCNJVXUFLACK-UHFFFAOYSA-N
XLogP2.60
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.42
LogP ≤ 52.60
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-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine?
The IUPAC name of N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine (CID 123621595) is N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine.
What is the SMILES notation for N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine?
The canonical SMILES for N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine is C=C[SiH](ONC(C)=C(C)C)ONC(C)=C(C)C.
What is the InChIKey of N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine?
The InChIKey is OHYCNJVXUFLACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2Si/c1-8-17(15-13-11(6)9(2)3)16-14-12(7)10(4)5/h8,13-14,17H,1H2,2-7H3.
What are the key properties of N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine?
N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine has a molecular weight of 256.42 g/mol, XLogP of 2.60, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethenyl-(3-methylbut-2-en-2-ylamino)oxysilyl]oxy-3-methylbut-2-en-2-amine is sourced from PubChem (CID 123621595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).