ethane;1,2,9-trimethylcarbazole

C23H39N — CID 160838686

IUPACethane;1,2,9-trimethylcarbazole
SMILESCC.CC.CC.CC.Cc1ccc2c3ccccc3n(C)c2c1C
InChIInChI=1S/C15H15N.4C2H6/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2;4*1-2/h4-9H,1-3H3;4*1-2H3
InChIKeySHSUXUJLERLIFY-UHFFFAOYSA-N
MW329.57 g/mol
LogP8.05
Rot. Bonds

About ethane;1,2,9-trimethylcarbazole

ethane;1,2,9-trimethylcarbazole (PubChem CID 160838686) has the molecular formula C23H39N and a molecular weight of 329.57 g/mol. Its IUPAC name is ethane;1,2,9-trimethylcarbazole.

Molecular Properties

Compound Nameethane;1,2,9-trimethylcarbazole
PubChem CID160838686
Molecular FormulaC23H39N
Molecular Weight329.57 g/mol
Exact Mass329.31
IUPAC Nameethane;1,2,9-trimethylcarbazole
SMILESCC.CC.CC.CC.Cc1ccc2c3ccccc3n(C)c2c1C
InChIInChI=1S/C15H15N.4C2H6/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2;4*1-2/h4-9H,1-3H3;4*1-2H3
InChIKeySHSUXUJLERLIFY-UHFFFAOYSA-N
XLogP8.05
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.57
LogP ≤ 58.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5,11-dimethylbenzo[a]carbazole
CID 58410472
2,9-dimethyl-1-[(Z)-prop-1-enyl]carbazole
CID 163717056
ethane;bis(9-methylcarbazole)
CID 159710949
ethane;9-methylcarbazole;triphenylene
CID 142356751
5,6,11,12-tetramethylindolo[3,2-b]carbazole
CID 134194403
ethane;9-methylcarbazol-1-amine
CID 142426342
ethane;1,2,9-trimethylpyrido[3,4-b]indol-2-ium
CID 159069654
ethane;1,2,3-trimethylindole
CID 91590745
1,9,10-trimethylimidazo[4,5-b]carbazole
CID 158614812
1-fluoro-9-methylcarbazole
CID 139447921
12-ethyl-11-methylindolo[2,3-a]carbazole
CID 90350910
5,6,7,12-tetramethylindolo[3,2-c]carbazole
CID 134194406

Frequently Asked Questions

What is the IUPAC name of ethane;1,2,9-trimethylcarbazole?
The IUPAC name of ethane;1,2,9-trimethylcarbazole (CID 160838686) is ethane;1,2,9-trimethylcarbazole.
What is the SMILES notation for ethane;1,2,9-trimethylcarbazole?
The canonical SMILES for ethane;1,2,9-trimethylcarbazole is CC.CC.CC.CC.Cc1ccc2c3ccccc3n(C)c2c1C.
What is the InChIKey of ethane;1,2,9-trimethylcarbazole?
The InChIKey is SHSUXUJLERLIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N.4C2H6/c1-10-8-9-13-12-6-4-5-7-14(12)16(3)15(13)11(10)2;4*1-2/h4-9H,1-3H3;4*1-2H3.
What are the key properties of ethane;1,2,9-trimethylcarbazole?
ethane;1,2,9-trimethylcarbazole has a molecular weight of 329.57 g/mol, XLogP of 8.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,2,9-trimethylcarbazole is sourced from PubChem (CID 160838686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).