9-(2H-thiopyran-6-yl)carbazole

C17H13NS — CID 70404322

IUPAC9-(2H-thiopyran-6-yl)carbazole
SMILESC1=CCSC(n2c3ccccc3c3ccccc32)=C1
InChIInChI=1S/C17H13NS/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)18(15)17-11-5-6-12-19-17/h1-11H,12H2
InChIKeyJVPDOOWTKWPEMZ-UHFFFAOYSA-N
MW263.37 g/mol
LogP4.90
Rot. Bonds1

About 9-(2H-thiopyran-6-yl)carbazole

9-(2H-thiopyran-6-yl)carbazole (PubChem CID 70404322) has the molecular formula C17H13NS and a molecular weight of 263.37 g/mol. Its IUPAC name is 9-(2H-thiopyran-6-yl)carbazole.

Molecular Properties

Compound Name9-(2H-thiopyran-6-yl)carbazole
PubChem CID70404322
Molecular FormulaC17H13NS
Molecular Weight263.37 g/mol
Exact Mass263.08
IUPAC Name9-(2H-thiopyran-6-yl)carbazole
SMILESC1=CCSC(n2c3ccccc3c3ccccc32)=C1
InChIInChI=1S/C17H13NS/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)18(15)17-11-5-6-12-19-17/h1-11H,12H2
InChIKeyJVPDOOWTKWPEMZ-UHFFFAOYSA-N
XLogP4.90
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(6-methylcyclohexa-1,3-dien-1-yl)carbazole
CID 152848775
9-[3,5-di(carbazol-9-yl)phenyl]carbazole;molecular hydrogen
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9-methyl-2H-thiopyrano[2,3-b]indole
CID 175258385
9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
CID 154791880
11-cyclohexa-1,3-dien-1-yl-12-phenylindolo[2,3-a]carbazole
CID 134390608
2-carbazol-9-ylbenzene-1,3-diamine
CID 122584908
9-(1,2-dihydropyridin-6-yl)carbazol-2-ol
CID 163636559
9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole
CID 59348313
5-carbazol-9-yl-N,N-diphenylthiophen-2-amine
CID 171601547
9-(1-carbazol-9-yl-2H-pyridin-3-yl)carbazole
CID 121412519
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201

Frequently Asked Questions

What is the IUPAC name of 9-(2H-thiopyran-6-yl)carbazole?
The IUPAC name of 9-(2H-thiopyran-6-yl)carbazole (CID 70404322) is 9-(2H-thiopyran-6-yl)carbazole.
What is the SMILES notation for 9-(2H-thiopyran-6-yl)carbazole?
The canonical SMILES for 9-(2H-thiopyran-6-yl)carbazole is C1=CCSC(n2c3ccccc3c3ccccc32)=C1.
What is the InChIKey of 9-(2H-thiopyran-6-yl)carbazole?
The InChIKey is JVPDOOWTKWPEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NS/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)18(15)17-11-5-6-12-19-17/h1-11H,12H2.
What are the key properties of 9-(2H-thiopyran-6-yl)carbazole?
9-(2H-thiopyran-6-yl)carbazole has a molecular weight of 263.37 g/mol, XLogP of 4.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2H-thiopyran-6-yl)carbazole is sourced from PubChem (CID 70404322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).