2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide

C15H14N2O2S — CID 102711764

IUPAC2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide
SMILESCC(NC(=O)c1ccc2c(c1)NC(=O)C2)c1cccs1
InChIInChI=1S/C15H14N2O2S/c1-9(13-3-2-6-20-13)16-15(19)11-5-4-10-8-14(18)17-12(10)7-11/h2-7,9H,8H2,1H3,(H,16,19)(H,17,18)
InChIKeyDUQUHDISHNPVNP-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.73
Rot. Bonds3

About 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide

2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide (PubChem CID 102711764) has the molecular formula C15H14N2O2S and a molecular weight of 286.36 g/mol. Its IUPAC name is 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide
PubChem CID102711764
Molecular FormulaC15H14N2O2S
Molecular Weight286.36 g/mol
Exact Mass286.08
IUPAC Name2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide
SMILESCC(NC(=O)c1ccc2c(c1)NC(=O)C2)c1cccs1
InChIInChI=1S/C15H14N2O2S/c1-9(13-3-2-6-20-13)16-15(19)11-5-4-10-8-14(18)17-12(10)7-11/h2-7,9H,8H2,1H3,(H,16,19)(H,17,18)
InChIKeyDUQUHDISHNPVNP-UHFFFAOYSA-N
XLogP2.73
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43534403
(2R)-4-methyl-2-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]pentanoic acid
CID 102710687
(2S)-3-methyl-2-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]pentanoic acid
CID 102710671
3-[[(1R)-1-thiophen-2-ylethyl]carbamoyl]benzoic acid
CID 51704015
4-amino-3-methyl-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 81408416
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918060
3-methyl-4-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]butanoic acid
CID 102710806
2-oxo-N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-dihydroindole-6-carboxamide
CID 102712241
4-chloro-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7742310
3-fluoro-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 7742328
3-methyl-4-(methylamino)-N-(1-thiophen-2-ylethyl)benzamide
CID 63210486

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide?
The IUPAC name of 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide (CID 102711764) is 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide.
What is the SMILES notation for 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide?
The canonical SMILES for 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide is CC(NC(=O)c1ccc2c(c1)NC(=O)C2)c1cccs1.
What is the InChIKey of 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide?
The InChIKey is DUQUHDISHNPVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S/c1-9(13-3-2-6-20-13)16-15(19)11-5-4-10-8-14(18)17-12(10)7-11/h2-7,9H,8H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide?
2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide has a molecular weight of 286.36 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 102711764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).