(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile

C9H13N3OSi — CID 134932739

IUPAC(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile
SMILESC[Si](C)(C)ON(/C=C\C#N)/C=C\C#N
InChIInChI=1S/C9H13N3OSi/c1-14(2,3)13-12(8-4-6-10)9-5-7-11/h4-5,8-9H,1-3H3/b8-4-,9-5-
InChIKeyPVSGHZJNTXSCRY-XEQVNJCQSA-N
MW207.31 g/mol
LogP2.13
Rot. Bonds4

About (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile

(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile (PubChem CID 134932739) has the molecular formula C9H13N3OSi and a molecular weight of 207.31 g/mol. Its IUPAC name is (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile.

Molecular Properties

Compound Name(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile
PubChem CID134932739
Molecular FormulaC9H13N3OSi
Molecular Weight207.31 g/mol
Exact Mass207.08
IUPAC Name(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile
SMILESC[Si](C)(C)ON(/C=C\C#N)/C=C\C#N
InChIInChI=1S/C9H13N3OSi/c1-14(2,3)13-12(8-4-6-10)9-5-7-11/h4-5,8-9H,1-3H3/b8-4-,9-5-
InChIKeyPVSGHZJNTXSCRY-XEQVNJCQSA-N
XLogP2.13
TPSA60.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.31
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile with MolForge

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

Launch Full Analysis

Related Compounds

3-[2-cyanoethenyl(trimethylsilyl)amino]prop-2-enenitrile
CID 175095303
(E)-3-[di(propan-2-yl)amino]prop-2-enenitrile
CID 5368921
(2Z,4Z,6Z)-7-(dimethylamino)hepta-2,4,6-trienenitrile
CID 14086796
(2E,4E)-6,6-dimethoxyhexa-2,4-dienenitrile
CID 10582967
3-methoxyprop-2-enenitrile
CID 2723755
(E)-(413C)but-2-enenitrile
CID 10986149
cyanocyanamide;trimethyl(trimethylsilyloxy)silane
CID 172795747
(E)-3-[(E)-2-cyanoethenoxy]prop-2-enenitrile
CID 20510390
(E)-3-(N,2-dimethylanilino)prop-2-enenitrile
CID 88538395
bicyclo[4.1.0]hepta-1,3,5-trien-7-one;3-(dimethylamino)prop-2-enenitrile
CID 174447849
(E)-5-[tert-butyl(dimethyl)silyl]oxy-4,4-dimethylpent-2-enenitrile
CID 101169649
(2E)-2,4-bis(trimethylsilyloxy)penta-2,4-dienenitrile
CID 101092842

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile?
The IUPAC name of (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile (CID 134932739) is (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile.
What is the SMILES notation for (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile?
The canonical SMILES for (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile is C[Si](C)(C)ON(/C=C\C#N)/C=C\C#N.
What is the InChIKey of (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile?
The InChIKey is PVSGHZJNTXSCRY-XEQVNJCQSA-N. The full InChI is InChI=1S/C9H13N3OSi/c1-14(2,3)13-12(8-4-6-10)9-5-7-11/h4-5,8-9H,1-3H3/b8-4-,9-5-.
What are the key properties of (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile?
(Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile has a molecular weight of 207.31 g/mol, XLogP of 2.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[[(Z)-2-cyanoethenyl]-trimethylsilyloxyamino]prop-2-enenitrile is sourced from PubChem (CID 134932739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).