8-ethyl-2,3,4,9-tetrahydro-1H-carbazole

C14H17N — CID 21239685

IUPAC8-ethyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESCCc1cccc2c3c([nH]c12)CCCC3
InChIInChI=1S/C14H17N/c1-2-10-6-5-8-12-11-7-3-4-9-13(11)15-14(10)12/h5-6,8,15H,2-4,7,9H2,1H3
InChIKeyIWTUDWGXXPGTIO-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.61
Rot. Bonds1

About 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole

8-ethyl-2,3,4,9-tetrahydro-1H-carbazole (PubChem CID 21239685) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole.

Molecular Properties

Compound Name8-ethyl-2,3,4,9-tetrahydro-1H-carbazole
PubChem CID21239685
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name8-ethyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESCCc1cccc2c3c([nH]c12)CCCC3
InChIInChI=1S/C14H17N/c1-2-10-6-5-8-12-11-7-3-4-9-13(11)15-14(10)12/h5-6,8,15H,2-4,7,9H2,1H3
InChIKeyIWTUDWGXXPGTIO-UHFFFAOYSA-N
XLogP3.61
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole?
The IUPAC name of 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole (CID 21239685) is 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole.
What is the SMILES notation for 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole?
The canonical SMILES for 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole is CCc1cccc2c3c([nH]c12)CCCC3.
What is the InChIKey of 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole?
The InChIKey is IWTUDWGXXPGTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-2-10-6-5-8-12-11-7-3-4-9-13(11)15-14(10)12/h5-6,8,15H,2-4,7,9H2,1H3.
What are the key properties of 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole?
8-ethyl-2,3,4,9-tetrahydro-1H-carbazole has a molecular weight of 199.30 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-2,3,4,9-tetrahydro-1H-carbazole is sourced from PubChem (CID 21239685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).