N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide

C17H23N3O2S — CID 91924450

IUPACN-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESCCOCCCNC(=O)C1CCc2ncc(-c3ccsc3)n2C1
InChIInChI=1S/C17H23N3O2S/c1-2-22-8-3-7-18-17(21)13-4-5-16-19-10-15(20(16)11-13)14-6-9-23-12-14/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,18,21)
InChIKeyTWJWUVJQMRZAQK-UHFFFAOYSA-N
MW333.46 g/mol
LogP2.72
Rot. Bonds7

About N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide

N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 91924450) has the molecular formula C17H23N3O2S and a molecular weight of 333.46 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID91924450
Molecular FormulaC17H23N3O2S
Molecular Weight333.46 g/mol
Exact Mass333.15
IUPAC NameN-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESCCOCCCNC(=O)C1CCc2ncc(-c3ccsc3)n2C1
InChIInChI=1S/C17H23N3O2S/c1-2-22-8-3-7-18-17(21)13-4-5-16-19-10-15(20(16)11-13)14-6-9-23-12-14/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,18,21)
InChIKeyTWJWUVJQMRZAQK-UHFFFAOYSA-N
XLogP2.72
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-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-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide (CID 91924450) is N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide is CCOCCCNC(=O)C1CCc2ncc(-c3ccsc3)n2C1.
What is the InChIKey of N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is TWJWUVJQMRZAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2S/c1-2-22-8-3-7-18-17(21)13-4-5-16-19-10-15(20(16)11-13)14-6-9-23-12-14/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,18,21).
What are the key properties of N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 333.46 g/mol, XLogP of 2.72, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 91924450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).