N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine

C11H22N2O2Si — CID 57042715

IUPACN-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine
SMILESC=C[Si](C)(ONC(C)=CC)ONC(C)=CC
InChIInChI=1S/C11H22N2O2Si/c1-7-10(4)12-14-16(6,9-3)15-13-11(5)8-2/h7-9,12-13H,3H2,1-2,4-6H3
InChIKeySTQMJFKKGGFQSC-UHFFFAOYSA-N
MW242.39 g/mol
LogP2.67
Rot. Bonds7

About N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine

N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine (PubChem CID 57042715) has the molecular formula C11H22N2O2Si and a molecular weight of 242.39 g/mol. Its IUPAC name is N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine.

Molecular Properties

Compound NameN-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine
PubChem CID57042715
Molecular FormulaC11H22N2O2Si
Molecular Weight242.39 g/mol
Exact Mass242.15
IUPAC NameN-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine
SMILESC=C[Si](C)(ONC(C)=CC)ONC(C)=CC
InChIInChI=1S/C11H22N2O2Si/c1-7-10(4)12-14-16(6,9-3)15-13-11(5)8-2/h7-9,12-13H,3H2,1-2,4-6H3
InChIKeySTQMJFKKGGFQSC-UHFFFAOYSA-N
XLogP2.67
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 52.67
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-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine?
The IUPAC name of N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine (CID 57042715) is N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine.
What is the SMILES notation for N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine?
The canonical SMILES for N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine is C=C[Si](C)(ONC(C)=CC)ONC(C)=CC.
What is the InChIKey of N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine?
The InChIKey is STQMJFKKGGFQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2Si/c1-7-10(4)12-14-16(6,9-3)15-13-11(5)8-2/h7-9,12-13H,3H2,1-2,4-6H3.
What are the key properties of N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine?
N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine has a molecular weight of 242.39 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(but-2-en-2-ylamino)oxy-ethenyl-methylsilyl]oxybut-2-en-2-amine is sourced from PubChem (CID 57042715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).