2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole

C13H13NS — CID 65042265

IUPAC2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole
SMILESc1csc(CC2Cc3ccccc3N2)c1
InChIInChI=1S/C13H13NS/c1-2-6-13-10(4-1)8-11(14-13)9-12-5-3-7-15-12/h1-7,11,14H,8-9H2
InChIKeyUDELQXYAQGTPOE-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.33
Rot. Bonds2

About 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole

2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole (PubChem CID 65042265) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole
PubChem CID65042265
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Name2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole
SMILESc1csc(CC2Cc3ccccc3N2)c1
InChIInChI=1S/C13H13NS/c1-2-6-13-10(4-1)8-11(14-13)9-12-5-3-7-15-12/h1-7,11,14H,8-9H2
InChIKeyUDELQXYAQGTPOE-UHFFFAOYSA-N
XLogP3.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-benzyl-2,3-dihydro-1H-indole
CID 71608217
[(2S)-2,3-dihydro-1H-indol-2-yl]methanamine
CID 82667971
(2S)-2-(iodomethyl)-2,3-dihydro-1H-indole
CID 26338665
(2S)-N-cyclopropyl-N-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61164482
(2R)-2-prop-2-enyl-2,3-dihydro-1H-indole
CID 1380957
2-[(4-tert-butylphenyl)methyl]-2,3-dihydro-1H-indole
CID 65042023
2-(2,3-dihydro-1H-indol-2-yl)ethanamine;dihydrochloride
CID 165454907
2-[(3-methylphenyl)methyl]-2,3-dihydro-1H-indole
CID 65041975
(2S)-2-(thiophen-2-ylmethyl)azepane
CID 94481267
3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol
CID 10976039
3-(thiophen-2-ylmethyl)-1,3-dihydroindol-2-one
CID 2803153
2-(2-methylbutyl)-2,3-dihydro-1H-indole
CID 65042120

Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole?
The IUPAC name of 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole (CID 65042265) is 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole is c1csc(CC2Cc3ccccc3N2)c1.
What is the InChIKey of 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole?
The InChIKey is UDELQXYAQGTPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NS/c1-2-6-13-10(4-1)8-11(14-13)9-12-5-3-7-15-12/h1-7,11,14H,8-9H2.
What are the key properties of 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole?
2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole has a molecular weight of 215.32 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 65042265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).