N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide

C14H22N2O3 — CID 125490909

IUPACN-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOCCCNC(=O)c1cc(C)c(CC)[nH]c1=O
InChIInChI=1S/C14H22N2O3/c1-4-12-10(3)9-11(14(18)16-12)13(17)15-7-6-8-19-5-2/h9H,4-8H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyMBUBGFYBXVRFGY-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.40
Rot. Bonds7

About N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide

N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 125490909) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID125490909
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOCCCNC(=O)c1cc(C)c(CC)[nH]c1=O
InChIInChI=1S/C14H22N2O3/c1-4-12-10(3)9-11(14(18)16-12)13(17)15-7-6-8-19-5-2/h9H,4-8H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyMBUBGFYBXVRFGY-UHFFFAOYSA-N
XLogP1.40
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-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

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 125490909) is N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide is CCOCCCNC(=O)c1cc(C)c(CC)[nH]c1=O.
What is the InChIKey of N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is MBUBGFYBXVRFGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-12-10(3)9-11(14(18)16-12)13(17)15-7-6-8-19-5-2/h9H,4-8H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 1.40, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 125490909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).