carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)

C20H28NY — CID 23381604

IUPACcarbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)
SMILESCc1[c-]ccc(C)c1C.Cc1cc([NH-])c(C)c(C)c1C.[CH3-].[Y+3]
InChIInChI=1S/C10H14N.C9H11.CH3.Y/c1-6-5-10(11)9(4)8(3)7(6)2;1-7-5-4-6-8(2)9(7)3;;/h5,11H,1-4H3;4-5H,1-3H3;1H3;/q3*-1;+3
InChIKeyRHVQVKXVJOQALP-UHFFFAOYSA-N
MW371.36 g/mol
LogP6.46
Rot. Bonds

About carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)

carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) (PubChem CID 23381604) has the molecular formula C20H28NY and a molecular weight of 371.36 g/mol. Its IUPAC name is carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+).

Molecular Properties

Compound Namecarbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)
PubChem CID23381604
Molecular FormulaC20H28NY
Molecular Weight371.36 g/mol
Exact Mass371.13
IUPAC Namecarbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)
SMILESCc1[c-]ccc(C)c1C.Cc1cc([NH-])c(C)c(C)c1C.[CH3-].[Y+3]
InChIInChI=1S/C10H14N.C9H11.CH3.Y/c1-6-5-10(11)9(4)8(3)7(6)2;1-7-5-4-6-8(2)9(7)3;;/h5,11H,1-4H3;4-5H,1-3H3;1H3;/q3*-1;+3
InChIKeyRHVQVKXVJOQALP-UHFFFAOYSA-N
XLogP6.46
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.36
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) with MolForge

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Related Compounds

magnesium;hydroxysilane;1,2,3-trimethylbenzene-6-ide
CID 173351353
lithium (2,3,4-trimethylphenyl)azanide
CID 141493779
4,6,7,8-tetramethyl-1H-naphthalen-1-ide;ytterbium
CID 58669101
1,2,3,4-tetramethylbenzene;bis(1,2,3,5-tetramethylbenzene)
CID 158514008
2-[di(ethyl)sulfamoyl]-N-hydroxy-2-methylpropanamide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)
CID 21068669
ruthenium;1,2,3,4-tetramethylbenzene
CID 158325243
formaldehyde;1,2,3,4,5-pentamethylbenzene
CID 162197138
magnesium;1,2-dimethylbenzene-6-ide;chloride
CID 78061659
lithium 1,2-difluoro-3-methylbenzene-6-ide
CID 59346107
magnesium;1,2-dimethylbenzene-6-ide;iodide
CID 87227373
lithium (3-chloro-4-methylphenyl)azanide
CID 101026876
3-methylbenzene-6-ide-1-carbaldehyde;yttrium(3+)
CID 20785774

Frequently Asked Questions

What is the IUPAC name of carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)?
The IUPAC name of carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) (CID 23381604) is carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+).
What is the SMILES notation for carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)?
The canonical SMILES for carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) is Cc1[c-]ccc(C)c1C.Cc1cc([NH-])c(C)c(C)c1C.[CH3-].[Y+3].
What is the InChIKey of carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)?
The InChIKey is RHVQVKXVJOQALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N.C9H11.CH3.Y/c1-6-5-10(11)9(4)8(3)7(6)2;1-7-5-4-6-8(2)9(7)3;;/h5,11H,1-4H3;4-5H,1-3H3;1H3;/q3*-1;+3.
What are the key properties of carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+)?
carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) has a molecular weight of 371.36 g/mol, XLogP of 6.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;(2,3,4,5-tetramethylphenyl)azanide;1,2,3-trimethylbenzene-6-ide;yttrium(3+) is sourced from PubChem (CID 23381604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).