ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten

C6H9NW2-2 — CID 59665904

IUPACethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten
SMILESC[C-]=[W].[H]/[C-]=C/C(=[W])NC
InChIInChI=1S/C4H6N.C2H3.2W/c1-3-4-5-2;1-2;;/h1,3,5H,2H3;1H3;;/q2*-1;;
InChIKeyIOFJBDOQCOSCBH-UHFFFAOYSA-N
MW462.83 g/mol
LogP0.10
Rot. Bonds2

About ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten

ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten (PubChem CID 59665904) has the molecular formula C6H9NW2-2 and a molecular weight of 462.83 g/mol. Its IUPAC name is ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten.

Molecular Properties

Compound Nameethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten
PubChem CID59665904
Molecular FormulaC6H9NW2-2
Molecular Weight462.83 g/mol
Exact Mass462.98
IUPAC Nameethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten
SMILESC[C-]=[W].[H]/[C-]=C/C(=[W])NC
InChIInChI=1S/C4H6N.C2H3.2W/c1-3-4-5-2;1-2;;/h1,3,5H,2H3;1H3;;/q2*-1;;
InChIKeyIOFJBDOQCOSCBH-UHFFFAOYSA-N
XLogP0.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.83
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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aminomethylidenetungsten;1-ethoxyprop-2-enylidenetungsten
CID 59737785
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CID 58239434
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CID 160523765
2-pyrimidin-2-ylbuta-1,3-dien-1-ol;yttrium
CID 58943841
prop-2-enylidenevanadium;propylidenetungsten
CID 59367628
lanthanum(3+);propane;4-propan-2-ylhexa-1,4-diene
CID 146903770
neptunium;prop-1-ene
CID 134947185
copper bis(prop-1-ene)
CID 24942682
prop-1-ene;uranium
CID 59004569

Frequently Asked Questions

What is the IUPAC name of ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten?
The IUPAC name of ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten (CID 59665904) is ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten.
What is the SMILES notation for ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten?
The canonical SMILES for ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten is C[C-]=[W].[H]/[C-]=C/C(=[W])NC.
What is the InChIKey of ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten?
The InChIKey is IOFJBDOQCOSCBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N.C2H3.2W/c1-3-4-5-2;1-2;;/h1,3,5H,2H3;1H3;;/q2*-1;;.
What are the key properties of ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten?
ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten has a molecular weight of 462.83 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten is sourced from PubChem (CID 59665904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).