3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide

C14H19N3O2S — CID 82947525

IUPAC3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide
SMILESCCCOCCCNC(=O)c1sc2cnccc2c1N
InChIInChI=1S/C14H19N3O2S/c1-2-7-19-8-3-5-17-14(18)13-12(15)10-4-6-16-9-11(10)20-13/h4,6,9H,2-3,5,7-8,15H2,1H3,(H,17,18)
InChIKeyMNGZPJOEMUWEAZ-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.42
Rot. Bonds7

About 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide

3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide (PubChem CID 82947525) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide
PubChem CID82947525
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide
SMILESCCCOCCCNC(=O)c1sc2cnccc2c1N
InChIInChI=1S/C14H19N3O2S/c1-2-7-19-8-3-5-17-14(18)13-12(15)10-4-6-16-9-11(10)20-13/h4,6,9H,2-3,5,7-8,15H2,1H3,(H,17,18)
InChIKeyMNGZPJOEMUWEAZ-UHFFFAOYSA-N
XLogP2.42
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-amino-N-(3-propoxypropyl)thieno[2,3-c]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

3-amino-N-[3-(2-hydroxyethoxy)propyl]thieno[2,3-c]pyridine-2-carboxamide
CID 106311389
3-amino-N-(2-but-3-enoxyethyl)thieno[2,3-c]pyridine-2-carboxamide
CID 106410277
3-amino-N-(3-sulfamoylpropyl)thieno[2,3-c]pyridine-2-carboxamide
CID 114289295
3-amino-N-(3-methylbutyl)thieno[2,3-c]pyridine-2-carboxamide
CID 113269830
3-amino-N-(5-hydroxy-4-methylpentyl)thieno[2,3-c]pyridine-2-carboxamide
CID 106162924
3-amino-N-[(E)-pent-3-enyl]thieno[2,3-c]pyridine-2-carboxamide
CID 113466186
3-amino-N-(2-hydroxy-3-methoxypropyl)thieno[2,3-c]pyridine-2-carboxamide
CID 114289374
3-amino-N-(3-methoxy-2-methylpropyl)thieno[2,3-c]pyridine-2-carboxamide
CID 114289302
3-amino-N-(2-methylprop-2-enyl)thieno[2,3-c]pyridine-2-carboxamide
CID 114619385
1-(3-aminothieno[2,3-c]pyridin-2-yl)butan-1-one
CID 58826843
5-amino-N-[3-(2-hydroxyethoxy)propyl]thieno[2,3-c]pyridazine-6-carboxamide
CID 106311385
3-amino-N-(2-thiophen-2-ylethyl)thieno[2,3-c]pyridine-2-carboxamide
CID 114289113

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide (CID 82947525) is 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide is CCCOCCCNC(=O)c1sc2cnccc2c1N.
What is the InChIKey of 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is MNGZPJOEMUWEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-2-7-19-8-3-5-17-14(18)13-12(15)10-4-6-16-9-11(10)20-13/h4,6,9H,2-3,5,7-8,15H2,1H3,(H,17,18).
What are the key properties of 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide?
3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 293.39 g/mol, XLogP of 2.42, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-propoxypropyl)thieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 82947525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).