N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide

C15H16N2OS — CID 43534403

IUPACN-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(NC(=O)c1ccc2c(c1)CCN2)c1cccs1
InChIInChI=1S/C15H16N2OS/c1-10(14-3-2-8-19-14)17-15(18)12-4-5-13-11(9-12)6-7-16-13/h2-5,8-10,16H,6-7H2,1H3,(H,17,18)
InChIKeyLYVWTFSAHWTCLJ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.21
Rot. Bonds3

About N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide

N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 43534403) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID43534403
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(NC(=O)c1ccc2c(c1)CCN2)c1cccs1
InChIInChI=1S/C15H16N2OS/c1-10(14-3-2-8-19-14)17-15(18)12-4-5-13-11(9-12)6-7-16-13/h2-5,8-10,16H,6-7H2,1H3,(H,17,18)
InChIKeyLYVWTFSAHWTCLJ-UHFFFAOYSA-N
XLogP3.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 81374595
2-oxo-N-(1-thiophen-2-ylethyl)-1,3-dihydroindole-6-carboxamide
CID 102711764
methyl 2-(2,3-dihydro-1H-indole-5-carbonylamino)propanoate
CID 60780386
N-(4-hydroxybutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 83177553
4-amino-3-methyl-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 81408416
N-[(1S)-1-pyridin-4-ylethyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 81394978
4-amino-3-fluoro-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 81408321
3-[[(1R)-1-thiophen-2-ylethyl]carbamoyl]benzoic acid
CID 51704015
4-bromo-N-[(1R)-1-(2,3-dihydro-1H-indol-5-yl)ethyl]benzamide
CID 163213424
(2S)-2-(2,3-dihydro-1H-indole-5-carbonylamino)-3-methylpentanoic acid
CID 61174014
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918060

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide (CID 43534403) is N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide is CC(NC(=O)c1ccc2c(c1)CCN2)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is LYVWTFSAHWTCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-10(14-3-2-8-19-14)17-15(18)12-4-5-13-11(9-12)6-7-16-13/h2-5,8-10,16H,6-7H2,1H3,(H,17,18).
What are the key properties of N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 272.37 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 43534403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).