3-methyl-2-methylsulfanyl-9H-carbazole

C14H13NS — CID 130398130

IUPAC3-methyl-2-methylsulfanyl-9H-carbazole
SMILESCSc1cc2[nH]c3ccccc3c2cc1C
InChIInChI=1S/C14H13NS/c1-9-7-11-10-5-3-4-6-12(10)15-13(11)8-14(9)16-2/h3-8,15H,1-2H3
InChIKeyDRCPLTNPOMRTJF-UHFFFAOYSA-N
MW227.33 g/mol
LogP4.35
Rot. Bonds1

About 3-methyl-2-methylsulfanyl-9H-carbazole

3-methyl-2-methylsulfanyl-9H-carbazole (PubChem CID 130398130) has the molecular formula C14H13NS and a molecular weight of 227.33 g/mol. Its IUPAC name is 3-methyl-2-methylsulfanyl-9H-carbazole.

Molecular Properties

Compound Name3-methyl-2-methylsulfanyl-9H-carbazole
PubChem CID130398130
Molecular FormulaC14H13NS
Molecular Weight227.33 g/mol
Exact Mass227.08
IUPAC Name3-methyl-2-methylsulfanyl-9H-carbazole
SMILESCSc1cc2[nH]c3ccccc3c2cc1C
InChIInChI=1S/C14H13NS/c1-9-7-11-10-5-3-4-6-12(10)15-13(11)8-14(9)16-2/h3-8,15H,1-2H3
InChIKeyDRCPLTNPOMRTJF-UHFFFAOYSA-N
XLogP4.35
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-methylsulfanyl-9H-carbazole?
The IUPAC name of 3-methyl-2-methylsulfanyl-9H-carbazole (CID 130398130) is 3-methyl-2-methylsulfanyl-9H-carbazole.
What is the SMILES notation for 3-methyl-2-methylsulfanyl-9H-carbazole?
The canonical SMILES for 3-methyl-2-methylsulfanyl-9H-carbazole is CSc1cc2[nH]c3ccccc3c2cc1C.
What is the InChIKey of 3-methyl-2-methylsulfanyl-9H-carbazole?
The InChIKey is DRCPLTNPOMRTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NS/c1-9-7-11-10-5-3-4-6-12(10)15-13(11)8-14(9)16-2/h3-8,15H,1-2H3.
What are the key properties of 3-methyl-2-methylsulfanyl-9H-carbazole?
3-methyl-2-methylsulfanyl-9H-carbazole has a molecular weight of 227.33 g/mol, XLogP of 4.35, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-methylsulfanyl-9H-carbazole is sourced from PubChem (CID 130398130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).