4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole

C28H23N — CID 118149247

IUPAC4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole
SMILESCCc1cccc2c1c1ccccc1n2Cc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C28H23N/c1-2-20-9-7-13-27-28(20)25-11-5-6-12-26(25)29(27)18-19-14-15-24-22(16-19)17-21-8-3-4-10-23(21)24/h3-16H,2,17-18H2,1H3
InChIKeyNEDWSSJVWPZJRA-UHFFFAOYSA-N
MW373.50 g/mol
LogP6.98
Rot. Bonds3

About 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole

4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole (PubChem CID 118149247) has the molecular formula C28H23N and a molecular weight of 373.50 g/mol. Its IUPAC name is 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole.

Molecular Properties

Compound Name4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole
PubChem CID118149247
Molecular FormulaC28H23N
Molecular Weight373.50 g/mol
Exact Mass373.18
IUPAC Name4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole
SMILESCCc1cccc2c1c1ccccc1n2Cc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C28H23N/c1-2-20-9-7-13-27-28(20)25-11-5-6-12-26(25)29(27)18-19-14-15-24-22(16-19)17-21-8-3-4-10-23(21)24/h3-16H,2,17-18H2,1H3
InChIKeyNEDWSSJVWPZJRA-UHFFFAOYSA-N
XLogP6.98
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.50
LogP ≤ 56.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole?
The IUPAC name of 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole (CID 118149247) is 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole.
What is the SMILES notation for 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole?
The canonical SMILES for 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole is CCc1cccc2c1c1ccccc1n2Cc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole?
The InChIKey is NEDWSSJVWPZJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23N/c1-2-20-9-7-13-27-28(20)25-11-5-6-12-26(25)29(27)18-19-14-15-24-22(16-19)17-21-8-3-4-10-23(21)24/h3-16H,2,17-18H2,1H3.
What are the key properties of 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole?
4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole has a molecular weight of 373.50 g/mol, XLogP of 6.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-9-(9H-fluoren-2-ylmethyl)carbazole is sourced from PubChem (CID 118149247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).