N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide

C15H20N2O3 — CID 53159973

IUPACN-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide
SMILESCCC(=O)N1CCc2c(C(=O)NCCOC)cccc21
InChIInChI=1S/C15H20N2O3/c1-3-14(18)17-9-7-11-12(5-4-6-13(11)17)15(19)16-8-10-20-2/h4-6H,3,7-10H2,1-2H3,(H,16,19)
InChIKeyJFTUULOKNFANHA-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.36
Rot. Bonds5

About N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide

N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide (PubChem CID 53159973) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide
PubChem CID53159973
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide
SMILESCCC(=O)N1CCc2c(C(=O)NCCOC)cccc21
InChIInChI=1S/C15H20N2O3/c1-3-14(18)17-9-7-11-12(5-4-6-13(11)17)15(19)16-8-10-20-2/h4-6H,3,7-10H2,1-2H3,(H,16,19)
InChIKeyJFTUULOKNFANHA-UHFFFAOYSA-N
XLogP1.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide (CID 53159973) is N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide is CCC(=O)N1CCc2c(C(=O)NCCOC)cccc21.
What is the InChIKey of N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide?
The InChIKey is JFTUULOKNFANHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-3-14(18)17-9-7-11-12(5-4-6-13(11)17)15(19)16-8-10-20-2/h4-6H,3,7-10H2,1-2H3,(H,16,19).
What are the key properties of N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide?
N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide is sourced from PubChem (CID 53159973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).