carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium

C7H13NWY-2 — CID 159585568

IUPACcarbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium
SMILESCC.[CH3-].[H]/[C-]=N/C=CC=[W].[Y]
InChIInChI=1S/C4H4N.C2H6.CH3.W.Y/c1-3-4-5-2;1-2;;;/h1-4H;1-2H3;1H3;;/q-1;;-1;;
InChIKeyZPOVJZRFCCWJHM-UHFFFAOYSA-N
MW383.93 g/mol
LogP1.90
Rot. Bonds2

About carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium

carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium (PubChem CID 159585568) has the molecular formula C7H13NWY-2 and a molecular weight of 383.93 g/mol. Its IUPAC name is carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium.

Molecular Properties

Compound Namecarbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium
PubChem CID159585568
Molecular FormulaC7H13NWY-2
Molecular Weight383.93 g/mol
Exact Mass383.96
IUPAC Namecarbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium
SMILESCC.[CH3-].[H]/[C-]=N/C=CC=[W].[Y]
InChIInChI=1S/C4H4N.C2H6.CH3.W.Y/c1-3-4-5-2;1-2;;;/h1-4H;1-2H3;1H3;;/q-1;;-1;;
InChIKeyZPOVJZRFCCWJHM-UHFFFAOYSA-N
XLogP1.90
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.93
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Methylene propyleneamine
CID 18740882
N-prop-1-enylmethanimine
CID 20770478
[(Z)-3-(methanidylideneamino)prop-2-enylidene]tungsten
CID 20755338
carbanide;[(Z)-3-(methanidylideneamino)prop-2-enylidene]tungsten;yttrium
CID 23638714
N-[(Z)-prop-1-enyl]methanimine
CID 101061903
N-[(1Z)-buta-1,3-dienyl]methanimine;ethane
CID 141782702
ethene;N-[(Z)-prop-1-enyl]methanimine
CID 142000887
ethane;N-[(Z)-prop-1-enyl]methanimine
CID 144615433
N-[(1Z)-buta-1,3-dienyl]methanimine;methane
CID 145267256
(Z)-but-2-ene;N-ethenylmethanimine
CID 145520504
Carbanide;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium
CID 148779405
Ethane;3-(ethylideneamino)prop-2-enylidenetungsten
CID 160022859

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium?
The IUPAC name of carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium (CID 159585568) is carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium.
What is the SMILES notation for carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium?
The canonical SMILES for carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium is CC.[CH3-].[H]/[C-]=N/C=CC=[W].[Y].
What is the InChIKey of carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium?
The InChIKey is ZPOVJZRFCCWJHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N.C2H6.CH3.W.Y/c1-3-4-5-2;1-2;;;/h1-4H;1-2H3;1H3;;/q-1;;-1;;.
What are the key properties of carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium?
carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium has a molecular weight of 383.93 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;3-(methanidylideneamino)prop-2-enylidenetungsten;yttrium is sourced from PubChem (CID 159585568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).