1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone

C15H15NOS — CID 2971209

IUPAC1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone
SMILESCC1Cc2ccccc2N1C(=O)Cc1cccs1
InChIInChI=1S/C15H15NOS/c1-11-9-12-5-2-3-7-14(12)16(11)15(17)10-13-6-4-8-18-13/h2-8,11H,9-10H2,1H3
InChIKeyUNMIKNKEZHVKGA-UHFFFAOYSA-N
MW257.36 g/mol
LogP3.27
Rot. Bonds2

About 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone

1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone (PubChem CID 2971209) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone.

Molecular Properties

Compound Name1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone
PubChem CID2971209
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone
SMILESCC1Cc2ccccc2N1C(=O)Cc1cccs1
InChIInChI=1S/C15H15NOS/c1-11-9-12-5-2-3-7-14(12)16(11)15(17)10-13-6-4-8-18-13/h2-8,11H,9-10H2,1H3
InChIKeyUNMIKNKEZHVKGA-UHFFFAOYSA-N
XLogP3.27
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylphenyl)-2-(2-thienyl)acetamide
CID 670140
1-[5-(2,3-dihydro-1H-indol-1-ylcarbonyl)thiophen-2-yl]-2,2,2-trifluoroethan-1-one
CID 25023801
1-(2-thienylmethyl)-1H-indole-2,3-dione
CID 2996126
1-(2,3-Dihydro-indol-1-yl)-2-p-tolylsulfanyl-ethanone
CID 738380
1-[5-(2,3-dihydro-1H-indol-1-ylcarbonyl)thiophen-2-yl]-2,2-difluoroethan-1-one
CID 25023808
1-Methyl-5-{[(2-thienylmethyl)amino]sulfonyl}indolin-2-one
CID 1511491
1-[(5-Chloro-2-thienyl)carbonyl]indoline
CID 693000
1-(2,3-Dihydroindol-1-yl)-2-(phenylthio)ethanone
CID 736577
1-[3-(2-Thienyl)acryloyl]indoline
CID 885474
3-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butyl]-3-ethyl-1H-indol-2-one
CID 11566558
2a-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butyl]-1-methyl-4,5-dihydro-3H-benzo[cd]indol-2-one
CID 11740526
2a-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butyl]-1-ethyl-4,5-dihydro-3H-benzo[cd]indol-2-one
CID 18377388

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone?
The IUPAC name of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone (CID 2971209) is 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone.
What is the SMILES notation for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone?
The canonical SMILES for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone is CC1Cc2ccccc2N1C(=O)Cc1cccs1.
What is the InChIKey of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone?
The InChIKey is UNMIKNKEZHVKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c1-11-9-12-5-2-3-7-14(12)16(11)15(17)10-13-6-4-8-18-13/h2-8,11H,9-10H2,1H3.
What are the key properties of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone?
1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone has a molecular weight of 257.36 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-thiophen-2-ylethanone is sourced from PubChem (CID 2971209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).