ethane;bis(9-methylcarbazole)

C30H34N2 — CID 159710949

IUPACethane;bis(9-methylcarbazole)
SMILESCC.CC.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21
InChIInChI=1S/2C13H11N.2C2H6/c2*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-2/h2*2-9H,1H3;2*1-2H3
InChIKeyMYVFYGUDHHFWJI-UHFFFAOYSA-N
MW422.62 g/mol
LogP8.72
Rot. Bonds

About ethane;bis(9-methylcarbazole)

ethane;bis(9-methylcarbazole) (PubChem CID 159710949) has the molecular formula C30H34N2 and a molecular weight of 422.62 g/mol. Its IUPAC name is ethane;bis(9-methylcarbazole).

Molecular Properties

Compound Nameethane;bis(9-methylcarbazole)
PubChem CID159710949
Molecular FormulaC30H34N2
Molecular Weight422.62 g/mol
Exact Mass422.27
IUPAC Nameethane;bis(9-methylcarbazole)
SMILESCC.CC.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21
InChIInChI=1S/2C13H11N.2C2H6/c2*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-2/h2*2-9H,1H3;2*1-2H3
InChIKeyMYVFYGUDHHFWJI-UHFFFAOYSA-N
XLogP8.72
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.62
LogP ≤ 58.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;bis(9-methylcarbazole)?
The IUPAC name of ethane;bis(9-methylcarbazole) (CID 159710949) is ethane;bis(9-methylcarbazole).
What is the SMILES notation for ethane;bis(9-methylcarbazole)?
The canonical SMILES for ethane;bis(9-methylcarbazole) is CC.CC.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.
What is the InChIKey of ethane;bis(9-methylcarbazole)?
The InChIKey is MYVFYGUDHHFWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H11N.2C2H6/c2*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-2/h2*2-9H,1H3;2*1-2H3.
What are the key properties of ethane;bis(9-methylcarbazole)?
ethane;bis(9-methylcarbazole) has a molecular weight of 422.62 g/mol, XLogP of 8.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;bis(9-methylcarbazole) is sourced from PubChem (CID 159710949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).