5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole

C13H13NS — CID 102834212

IUPAC5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole
SMILESCc1sccc1-c1ccc2c(c1)CCN2
InChIInChI=1S/C13H13NS/c1-9-12(5-7-15-9)10-2-3-13-11(8-10)4-6-14-13/h2-3,5,7-8,14H,4,6H2,1H3
InChIKeyYVENQZXEBIBKLL-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.69
Rot. Bonds1

About 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole

5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole (PubChem CID 102834212) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole
PubChem CID102834212
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Name5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole
SMILESCc1sccc1-c1ccc2c(c1)CCN2
InChIInChI=1S/C13H13NS/c1-9-12(5-7-15-9)10-2-3-13-11(8-10)4-6-14-13/h2-3,5,7-8,14H,4,6H2,1H3
InChIKeyYVENQZXEBIBKLL-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,3,4,5,6-pentamethylphenyl)-2,3-dihydro-1H-indole
CID 63424136
2-(2,3-dihydro-1H-indol-5-yl)-4,5-dimethyl-1,3-thiazole
CID 82474601
5-(4-fluoro-2,6-dimethylphenyl)-2,3-dihydro-1H-indole
CID 106878936
5-(5,6,7,8-tetrahydronaphthalen-2-yl)-2,3-dihydro-1H-indole
CID 63424177
5-(4-methoxy-3-methylphenyl)-2,3-dihydro-1H-indole
CID 62502645
6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
CID 62502822
2,3-dihydro-1H-indol-5-yl-(3-methylthiophen-2-yl)methanone
CID 116554116
2-(2,3-dihydro-1H-indol-5-yl)benzoic acid
CID 82039135
5-(2-propoxyphenyl)-2,3-dihydro-1H-indole
CID 104660777
6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline
CID 62500792
3-(2,3-dihydro-1H-indol-5-yl)-N-methylaniline
CID 116998160
6-(2,3,4,5,6-pentamethylphenyl)-1,2,3,4-tetrahydroquinoline
CID 63424137

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole?
The IUPAC name of 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole (CID 102834212) is 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole?
The canonical SMILES for 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole is Cc1sccc1-c1ccc2c(c1)CCN2.
What is the InChIKey of 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole?
The InChIKey is YVENQZXEBIBKLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NS/c1-9-12(5-7-15-9)10-2-3-13-11(8-10)4-6-14-13/h2-3,5,7-8,14H,4,6H2,1H3.
What are the key properties of 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole?
5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole has a molecular weight of 215.32 g/mol, XLogP of 3.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylthiophen-3-yl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 102834212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).