2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide

C17H20N2O3 — CID 27859242

IUPAC2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCOc1cccc(C)c1
InChIInChI=1S/C17H20N2O3/c1-3-21-17-15(8-5-9-19-17)16(20)18-10-11-22-14-7-4-6-13(2)12-14/h4-9,12H,3,10-11H2,1-2H3,(H,18,20)
InChIKeyKNZDZWBABAMUTE-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.60
Rot. Bonds7

About 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide

2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide (PubChem CID 27859242) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
PubChem CID27859242
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCOc1cccc(C)c1
InChIInChI=1S/C17H20N2O3/c1-3-21-17-15(8-5-9-19-17)16(20)18-10-11-22-14-7-4-6-13(2)12-14/h4-9,12H,3,10-11H2,1-2H3,(H,18,20)
InChIKeyKNZDZWBABAMUTE-UHFFFAOYSA-N
XLogP2.60
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-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

2-hydrazinyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
CID 62235691
2,3-dihydroxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 114344196
N-[2-(3-bromophenoxy)ethyl]-2-methoxypyridine-3-carboxamide
CID 55919722
[2-[2-(3-methylphenoxy)ethylcarbamoyl]phenyl] acetate
CID 86574466
3-hydrazinyl-N-[2-(3-methylphenoxy)ethyl]pyridine-4-carboxamide
CID 105071680
6-methyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
CID 18148810
2-chloro-4,5-dimethoxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 86574521
N-[2-(3-methylphenoxy)ethyl]-2-(thiophene-2-carbonyl)benzamide
CID 9489216
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
3-ethoxy-4-methoxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 31916381
2-bromo-N-[2-(3-ethoxyphenoxy)ethyl]benzamide
CID 113100580
2-fluoro-6-hydroxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 104916567

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide (CID 27859242) is 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide is CCOc1ncccc1C(=O)NCCOc1cccc(C)c1.
What is the InChIKey of 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide?
The InChIKey is KNZDZWBABAMUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-3-21-17-15(8-5-9-19-17)16(20)18-10-11-22-14-7-4-6-13(2)12-14/h4-9,12H,3,10-11H2,1-2H3,(H,18,20).
What are the key properties of 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide?
2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 2.60, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 27859242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).