N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide

C18H23N3OS — CID 20940625

IUPACN-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccc(C(=O)NCCN(C)C)s1
InChIInChI=1S/C18H23N3OS/c1-13-12-14-6-4-5-7-15(14)21(13)17-9-8-16(23-17)18(22)19-10-11-20(2)3/h4-9,13H,10-12H2,1-3H3,(H,19,22)
InChIKeyVEWBVGLMXRKUAS-UHFFFAOYSA-N
MW329.47 g/mol
LogP3.12
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide

N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide (PubChem CID 20940625) has the molecular formula C18H23N3OS and a molecular weight of 329.47 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide
PubChem CID20940625
Molecular FormulaC18H23N3OS
Molecular Weight329.47 g/mol
Exact Mass329.16
IUPAC NameN-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccc(C(=O)NCCN(C)C)s1
InChIInChI=1S/C18H23N3OS/c1-13-12-14-6-4-5-7-15(14)21(13)17-9-8-16(23-17)18(22)19-10-11-20(2)3/h4-9,13H,10-12H2,1-3H3,(H,19,22)
InChIKeyVEWBVGLMXRKUAS-UHFFFAOYSA-N
XLogP3.12
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,3-dihydroindol-1-yl)-N-[2-(dimethylamino)ethyl]thiophene-2-carboxamide
CID 20940558
N-[2-(dimethylamino)ethyl]-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109366315
N-[3-(dimethylamino)propyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574658
N-[2-(dimethylamino)ethyl]-2,2-dimethyl-3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropanamide
CID 108960333
N-[3-(dimethylamino)propyl]-3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropanamide
CID 108944300
1-acetyl-N-[2-(dimethylamino)ethyl]-2,3-dihydroindole-2-carboxamide
CID 53299064
5-(2,3-dihydroindol-1-yl)-N-propylthiophene-2-carboxamide
CID 20940563
N-[3-(dimethylamino)propyl]-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109134117
3-[5-[2-(dimethylamino)ethylcarbamoyl]thiophen-2-yl]prop-2-enoic acid
CID 54971487
N-(2-hydroxyethyl)-6-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84570683
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide
CID 108994643
2-(2,5-dimethylpyrrol-1-yl)benzoic acid;ethane;2-(2-methyl-2,3-dihydroindol-1-yl)benzoic acid
CID 144620726

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide (CID 20940625) is N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide is CC1Cc2ccccc2N1c1ccc(C(=O)NCCN(C)C)s1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide?
The InChIKey is VEWBVGLMXRKUAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3OS/c1-13-12-14-6-4-5-7-15(14)21(13)17-9-8-16(23-17)18(22)19-10-11-20(2)3/h4-9,13H,10-12H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide?
N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide has a molecular weight of 329.47 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-5-(2-methyl-2,3-dihydroindol-1-yl)thiophene-2-carboxamide is sourced from PubChem (CID 20940625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).