7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole

C13H13NS — CID 3980200

IUPAC7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
SMILESCc1cccc2c1NC(c1cccs1)C2
InChIInChI=1S/C13H13NS/c1-9-4-2-5-10-8-11(14-13(9)10)12-6-3-7-15-12/h2-7,11,14H,8H2,1H3
InChIKeyVTBXSSYETWWGKM-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.77
Rot. Bonds1

About 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole

7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole (PubChem CID 3980200) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
PubChem CID3980200
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Name7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
SMILESCc1cccc2c1NC(c1cccs1)C2
InChIInChI=1S/C13H13NS/c1-9-4-2-5-10-8-11(14-13(9)10)12-6-3-7-15-12/h2-7,11,14H,8H2,1H3
InChIKeyVTBXSSYETWWGKM-UHFFFAOYSA-N
XLogP3.77
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 ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
CID 3505165
7-propan-2-yl-2-thiophen-2-yl-2,3-dihydro-1H-indole
CID 4556277
6-chloro-7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
CID 3618708
7-methyl-2-(5-methylthiophen-2-yl)-2,3-dihydro-1H-indole
CID 4646871
4-fluoro-7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
CID 3591204
7-methyl-2-pyridin-4-yl-2,3-dihydro-1H-indole
CID 4591288
2-(3,4-dimethylphenyl)-7-methyl-2,3-dihydro-1H-indole
CID 3984068
2-(2-chlorophenyl)-7-methyl-2,3-dihydro-1H-indole
CID 4312167
8-methyl-3-thiophen-2-yl-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine
CID 115285789
2-(4-methoxy-3-methylphenyl)-7-methyl-2,3-dihydro-1H-indole
CID 5224986
(3S)-3,8-dimethyl-1,2,3,4-tetrahydroquinoline
CID 42079847
(2R)-7-methyl-2-(trifluoromethyl)-2,3-dihydro-1H-indole
CID 130642989

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole?
The IUPAC name of 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole (CID 3980200) is 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole.
What is the SMILES notation for 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole?
The canonical SMILES for 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole is Cc1cccc2c1NC(c1cccs1)C2.
What is the InChIKey of 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole?
The InChIKey is VTBXSSYETWWGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NS/c1-9-4-2-5-10-8-11(14-13(9)10)12-6-3-7-15-12/h2-7,11,14H,8H2,1H3.
What are the key properties of 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole?
7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole has a molecular weight of 215.32 g/mol, XLogP of 3.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole is sourced from PubChem (CID 3980200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).