(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine

C14H29N3O3Si — CID 57266830

IUPAC(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine
SMILESC/C=C(/C)NO[Si](CC)(ON/C(C)=C/C)ON/C(C)=C/C
InChIInChI=1S/C14H29N3O3Si/c1-8-12(5)15-18-21(11-4,19-16-13(6)9-2)20-17-14(7)10-3/h8-10,15-17H,11H2,1-7H3/b12-8-,13-9+,14-10+
InChIKeyJWVYARUEIGLEMG-IIYJRUALSA-N
MW315.49 g/mol
LogP3.28
Rot. Bonds10

About (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine

(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine (PubChem CID 57266830) has the molecular formula C14H29N3O3Si and a molecular weight of 315.49 g/mol. Its IUPAC name is (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine
PubChem CID57266830
Molecular FormulaC14H29N3O3Si
Molecular Weight315.49 g/mol
Exact Mass315.20
IUPAC Name(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine
SMILESC/C=C(/C)NO[Si](CC)(ON/C(C)=C/C)ON/C(C)=C/C
InChIInChI=1S/C14H29N3O3Si/c1-8-12(5)15-18-21(11-4,19-16-13(6)9-2)20-17-14(7)10-3/h8-10,15-17H,11H2,1-7H3/b12-8-,13-9+,14-10+
InChIKeyJWVYARUEIGLEMG-IIYJRUALSA-N
XLogP3.28
TPSA63.78 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.49
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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 (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine?
The IUPAC name of (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine (CID 57266830) is (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine.
What is the SMILES notation for (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine?
The canonical SMILES for (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine is C/C=C(/C)NO[Si](CC)(ON/C(C)=C/C)ON/C(C)=C/C.
What is the InChIKey of (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine?
The InChIKey is JWVYARUEIGLEMG-IIYJRUALSA-N. The full InChI is InChI=1S/C14H29N3O3Si/c1-8-12(5)15-18-21(11-4,19-16-13(6)9-2)20-17-14(7)10-3/h8-10,15-17H,11H2,1-7H3/b12-8-,13-9+,14-10+.
What are the key properties of (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine?
(Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine has a molecular weight of 315.49 g/mol, XLogP of 3.28, 10 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[bis[[[(E)-but-2-en-2-yl]amino]oxy]-ethylsilyl]oxybut-2-en-2-amine is sourced from PubChem (CID 57266830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).