ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole

C34H32N2 — CID 167454384

IUPACethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole
SMILESCC.Cc1ccc2[nH]c3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C19H15N.C13H11N.C2H6/c1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-2/h2-13H,1H3;2-8,14H,1H3;1-2H3
InChIKeyVPDITBLQGVPLMC-UHFFFAOYSA-N
MW468.64 g/mol
LogP9.75
Rot. Bonds1

About ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole

ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole (PubChem CID 167454384) has the molecular formula C34H32N2 and a molecular weight of 468.64 g/mol. Its IUPAC name is ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole.

Molecular Properties

Compound Nameethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole
PubChem CID167454384
Molecular FormulaC34H32N2
Molecular Weight468.64 g/mol
Exact Mass468.26
IUPAC Nameethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole
SMILESCC.Cc1ccc2[nH]c3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C19H15N.C13H11N.C2H6/c1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-2/h2-13H,1H3;2-8,14H,1H3;1-2H3
InChIKeyVPDITBLQGVPLMC-UHFFFAOYSA-N
XLogP9.75
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.64
LogP ≤ 59.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;9-(3-methylphenyl)carbazole
CID 143904684
3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25208834
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075
2-carbazol-9-yl-7-methyl-9H-carbazole
CID 155179802
2-(3-carbazol-9-ylphenyl)-9H-carbazole
CID 118378581
9-(3-carbazol-9-ylphenyl)carbazole;9-(4-carbazol-9-ylphenyl)carbazole;3,6-dimethyl-9-phenylcarbazole;ethane;2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159290394
(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
CID 145055834
3-(9-phenylcarbazol-3-yl)-6-[4-(9-phenylcarbazol-3-yl)phenyl]-9H-carbazole
CID 59307187
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3-carbazol-9-yl-6-(2,4,6-trimethylphenyl)-9H-carbazole
CID 146281218
3-(9H-carbazol-2-yl)-9-(3-phenylphenyl)carbazole
CID 122652205
3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole
CID 59306787

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole?
The IUPAC name of ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole (CID 167454384) is ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole.
What is the SMILES notation for ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole?
The canonical SMILES for ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole is CC.Cc1ccc2[nH]c3ccccc3c2c1.Cc1cccc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole?
The InChIKey is VPDITBLQGVPLMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N.C13H11N.C2H6/c1-14-7-6-8-15(13-14)20-18-11-4-2-9-16(18)17-10-3-5-12-19(17)20;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-2/h2-13H,1H3;2-8,14H,1H3;1-2H3.
What are the key properties of ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole?
ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole has a molecular weight of 468.64 g/mol, XLogP of 9.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole is sourced from PubChem (CID 167454384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).