9-ethylsulfanylcarbazole

C14H13NS — CID 151528824

IUPAC9-ethylsulfanylcarbazole
SMILESCCSn1c2ccccc2c2ccccc21
InChIInChI=1S/C14H13NS/c1-2-16-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h3-10H,2H2,1H3
InChIKeyPWAUTFVZMVODJB-UHFFFAOYSA-N
MW227.33 g/mol
LogP4.31
Rot. Bonds2

About 9-ethylsulfanylcarbazole

9-ethylsulfanylcarbazole (PubChem CID 151528824) has the molecular formula C14H13NS and a molecular weight of 227.33 g/mol. Its IUPAC name is 9-ethylsulfanylcarbazole.

Molecular Properties

Compound Name9-ethylsulfanylcarbazole
PubChem CID151528824
Molecular FormulaC14H13NS
Molecular Weight227.33 g/mol
Exact Mass227.08
IUPAC Name9-ethylsulfanylcarbazole
SMILESCCSn1c2ccccc2c2ccccc21
InChIInChI=1S/C14H13NS/c1-2-16-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h3-10H,2H2,1H3
InChIKeyPWAUTFVZMVODJB-UHFFFAOYSA-N
XLogP4.31
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethylsulfanylcarbazole?
The IUPAC name of 9-ethylsulfanylcarbazole (CID 151528824) is 9-ethylsulfanylcarbazole.
What is the SMILES notation for 9-ethylsulfanylcarbazole?
The canonical SMILES for 9-ethylsulfanylcarbazole is CCSn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-ethylsulfanylcarbazole?
The InChIKey is PWAUTFVZMVODJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NS/c1-2-16-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h3-10H,2H2,1H3.
What are the key properties of 9-ethylsulfanylcarbazole?
9-ethylsulfanylcarbazole has a molecular weight of 227.33 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethylsulfanylcarbazole is sourced from PubChem (CID 151528824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).