N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide

C18H16F3N3O3 — CID 126776692

IUPACN-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
SMILESO=C(NCCC1C(=O)Nc2ccccc21)c1cccc(OCC(F)(F)F)n1
InChIInChI=1S/C18H16F3N3O3/c19-18(20,21)10-27-15-7-3-6-14(23-15)17(26)22-9-8-12-11-4-1-2-5-13(11)24-16(12)25/h1-7,12H,8-10H2,(H,22,26)(H,24,25)
InChIKeyFFEJLXDTJKTWCJ-UHFFFAOYSA-N
MW379.34 g/mol
LogP2.88
Rot. Bonds6

About N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide

N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide (PubChem CID 126776692) has the molecular formula C18H16F3N3O3 and a molecular weight of 379.34 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
PubChem CID126776692
Molecular FormulaC18H16F3N3O3
Molecular Weight379.34 g/mol
Exact Mass379.11
IUPAC NameN-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
SMILESO=C(NCCC1C(=O)Nc2ccccc21)c1cccc(OCC(F)(F)F)n1
InChIInChI=1S/C18H16F3N3O3/c19-18(20,21)10-27-15-7-3-6-14(23-15)17(26)22-9-8-12-11-4-1-2-5-13(11)24-16(12)25/h1-7,12H,8-10H2,(H,22,26)(H,24,25)
InChIKeyFFEJLXDTJKTWCJ-UHFFFAOYSA-N
XLogP2.88
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.34
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730209
2-methoxy-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730190
3,5-dimethoxy-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730193
N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-2-phenoxyacetamide
CID 110730204
2-methyl-3-[[6-(2,2,2-trifluoroethoxy)pyridine-2-carbonyl]amino]propanoic acid
CID 120525800
2-methyl-2-phenyl-3-[[6-(2,2,2-trifluoroethoxy)pyridine-2-carbonyl]amino]propanoic acid
CID 120700736
1-[2-[(3S)-2-oxo-1,3-dihydroindol-3-yl]ethyl]-3-phenylurea
CID 31771075
3-methyl-4-[[6-(2,2,2-trifluoroethoxy)pyridine-2-carbonyl]amino]butanoic acid
CID 120537132
methyl 3-(2-oxo-1,3-dihydroindol-3-yl)propanoate
CID 14903583
4-[[[6-(2,2,2-trifluoroethoxy)pyridine-2-carbonyl]amino]methyl]oxane-4-carboxylic acid
CID 120542907
1-(4-methoxyphenyl)-5-methyl-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]triazole-4-carboxamide
CID 126787614
N-[(1S)-1-cyanopropyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 97215424

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide (CID 126776692) is N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide is O=C(NCCC1C(=O)Nc2ccccc21)c1cccc(OCC(F)(F)F)n1.
What is the InChIKey of N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide?
The InChIKey is FFEJLXDTJKTWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F3N3O3/c19-18(20,21)10-27-15-7-3-6-14(23-15)17(26)22-9-8-12-11-4-1-2-5-13(11)24-16(12)25/h1-7,12H,8-10H2,(H,22,26)(H,24,25).
What are the key properties of N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide?
N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide has a molecular weight of 379.34 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-6-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide is sourced from PubChem (CID 126776692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).