1,2-dimethyl-3H-indol-3-ide;ethane;tungsten

C12H16NW- — CID 159784775

IUPAC1,2-dimethyl-3H-indol-3-ide;ethane;tungsten
SMILESCC.Cc1[c-]c2ccccc2n1C.[W]
InChIInChI=1S/C10H10N.C2H6.W/c1-8-7-9-5-3-4-6-10(9)11(8)2;1-2;/h3-6H,1-2H3;1-2H3;/q-1;;
InChIKeyAFFOVXBPZTXZRX-UHFFFAOYSA-N
MW358.11 g/mol
LogP3.31
Rot. Bonds

About 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten

1,2-dimethyl-3H-indol-3-ide;ethane;tungsten (PubChem CID 159784775) has the molecular formula C12H16NW- and a molecular weight of 358.11 g/mol. Its IUPAC name is 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten.

Molecular Properties

Compound Name1,2-dimethyl-3H-indol-3-ide;ethane;tungsten
PubChem CID159784775
Molecular FormulaC12H16NW-
Molecular Weight358.11 g/mol
Exact Mass358.08
IUPAC Name1,2-dimethyl-3H-indol-3-ide;ethane;tungsten
SMILESCC.Cc1[c-]c2ccccc2n1C.[W]
InChIInChI=1S/C10H10N.C2H6.W/c1-8-7-9-5-3-4-6-10(9)11(8)2;1-2;/h3-6H,1-2H3;1-2H3;/q-1;;
InChIKeyAFFOVXBPZTXZRX-UHFFFAOYSA-N
XLogP3.31
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.11
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,3-dimethyl-1,4-dihydronaphthalene-1,4-diide;praseodymium
CID 59074422
cadmium(2+);bis(1-methyl-3H-indol-3-ide)
CID 15969809
ethane;bis(9-methylcarbazole)
CID 159710949
1-methyl-2-[6-[2-[6-(1-methyl-3H-indol-3-id-2-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-3H-indol-3-ide;platinum(2+)
CID 140758633
ethane;9-methylcarbazole;triphenylene
CID 142356751
7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene
CID 89317326
ethane;1,2,3-trimethylindole
CID 91590745
ethane;10-methyl-9H-anthracen-9-ide;yttrium
CID 159274754
N-methyl-1-(1-phenyl-3H-indol-3-id-2-yl)methanamine;yttrium
CID 59071358
2-(1,3-dimethylindol-2-yl)-1,3-dimethylindole
CID 12742686
8-methyl-7,8,9-triazatricyclo[4.3.0.07,9]nona-1,3,5-triene
CID 59834052
5-(10H-anthracen-10-id-9-yl)-11-methylbenzo[a]carbazole;yttrium
CID 58410433

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten?
The IUPAC name of 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten (CID 159784775) is 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten.
What is the SMILES notation for 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten?
The canonical SMILES for 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten is CC.Cc1[c-]c2ccccc2n1C.[W].
What is the InChIKey of 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten?
The InChIKey is AFFOVXBPZTXZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N.C2H6.W/c1-8-7-9-5-3-4-6-10(9)11(8)2;1-2;/h3-6H,1-2H3;1-2H3;/q-1;;.
What are the key properties of 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten?
1,2-dimethyl-3H-indol-3-ide;ethane;tungsten has a molecular weight of 358.11 g/mol, XLogP of 3.31, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3H-indol-3-ide;ethane;tungsten is sourced from PubChem (CID 159784775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).