1,2,3,4,5,6,7,8-octaethyl-9H-carbazole

C28H41N — CID 90320915

IUPAC1,2,3,4,5,6,7,8-octaethyl-9H-carbazole
SMILESCCc1c(CC)c(CC)c2c([nH]c3c(CC)c(CC)c(CC)c(CC)c32)c1CC
InChIInChI=1S/C28H41N/c1-9-17-19(11-3)23(15-7)27-25(21(17)13-5)26-22(14-6)18(10-2)20(12-4)24(16-8)28(26)29-27/h29H,9-16H2,1-8H3
InChIKeyFFBHYRKMFZQFAE-UHFFFAOYSA-N
MW391.64 g/mol
LogP7.82
Rot. Bonds8

About 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole

1,2,3,4,5,6,7,8-octaethyl-9H-carbazole (PubChem CID 90320915) has the molecular formula C28H41N and a molecular weight of 391.64 g/mol. Its IUPAC name is 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole.

Molecular Properties

Compound Name1,2,3,4,5,6,7,8-octaethyl-9H-carbazole
PubChem CID90320915
Molecular FormulaC28H41N
Molecular Weight391.64 g/mol
Exact Mass391.32
IUPAC Name1,2,3,4,5,6,7,8-octaethyl-9H-carbazole
SMILESCCc1c(CC)c(CC)c2c([nH]c3c(CC)c(CC)c(CC)c(CC)c32)c1CC
InChIInChI=1S/C28H41N/c1-9-17-19(11-3)23(15-7)27-25(21(17)13-5)26-22(14-6)18(10-2)20(12-4)24(16-8)28(26)29-27/h29H,9-16H2,1-8H3
InChIKeyFFBHYRKMFZQFAE-UHFFFAOYSA-N
XLogP7.82
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.64
LogP ≤ 57.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole?
The IUPAC name of 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole (CID 90320915) is 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole.
What is the SMILES notation for 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole?
The canonical SMILES for 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole is CCc1c(CC)c(CC)c2c([nH]c3c(CC)c(CC)c(CC)c(CC)c32)c1CC.
What is the InChIKey of 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole?
The InChIKey is FFBHYRKMFZQFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H41N/c1-9-17-19(11-3)23(15-7)27-25(21(17)13-5)26-22(14-6)18(10-2)20(12-4)24(16-8)28(26)29-27/h29H,9-16H2,1-8H3.
What are the key properties of 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole?
1,2,3,4,5,6,7,8-octaethyl-9H-carbazole has a molecular weight of 391.64 g/mol, XLogP of 7.82, 8 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6,7,8-octaethyl-9H-carbazole is sourced from PubChem (CID 90320915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).