N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide

C12H18N2O4 — CID 114263707

IUPACN-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide
SMILESCCN(CCOCCO)C(=O)c1cncc(O)c1
InChIInChI=1S/C12H18N2O4/c1-2-14(3-5-18-6-4-15)12(17)10-7-11(16)9-13-8-10/h7-9,15-16H,2-6H2,1H3
InChIKeyHAZJXODJHOFMNA-UHFFFAOYSA-N
MW254.29 g/mol
LogP0.26
Rot. Bonds7

About N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide

N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide (PubChem CID 114263707) has the molecular formula C12H18N2O4 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide
PubChem CID114263707
Molecular FormulaC12H18N2O4
Molecular Weight254.29 g/mol
Exact Mass254.13
IUPAC NameN-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide
SMILESCCN(CCOCCO)C(=O)c1cncc(O)c1
InChIInChI=1S/C12H18N2O4/c1-2-14(3-5-18-6-4-15)12(17)10-7-11(16)9-13-8-10/h7-9,15-16H,2-6H2,1H3
InChIKeyHAZJXODJHOFMNA-UHFFFAOYSA-N
XLogP0.26
TPSA82.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)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

N-ethyl-5-hydroxy-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 63850012
N-[3-(diethylamino)propyl]-N-ethyl-5-hydroxypyridine-3-carboxamide
CID 102993953
N-ethyl-5-hydroxy-N-prop-2-ynylpyridine-3-carboxamide
CID 79725826
5-bromo-N-ethyl-N-[2-(2-hydroxyethoxy)ethyl]thiophene-3-carboxamide
CID 114263702
N-(2-cyanopropyl)-N-ethyl-5-hydroxypyridine-3-carboxamide
CID 63861022
N-(2-ethoxyethyl)-N-ethyl-5-nitropyridine-3-carboxamide
CID 21405335
N-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 114263805
5-bromo-N-ethyl-N-(3-hydroxypropyl)pyridine-3-carboxamide
CID 115772011
N-(3-ethoxypropyl)-5-hydroxy-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 63859737
5-hydroxy-N-(2-hydroxyethyl)-N-pentan-3-ylpyridine-3-carboxamide
CID 63850846
5-hydroxy-N-(2-methoxyethyl)-N-methylpyridine-3-carboxamide
CID 63866551
5-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 55256550

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide?
The IUPAC name of N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide (CID 114263707) is N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide is CCN(CCOCCO)C(=O)c1cncc(O)c1.
What is the InChIKey of N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide?
The InChIKey is HAZJXODJHOFMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4/c1-2-14(3-5-18-6-4-15)12(17)10-7-11(16)9-13-8-10/h7-9,15-16H,2-6H2,1H3.
What are the key properties of N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide?
N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide has a molecular weight of 254.29 g/mol, XLogP of 0.26, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-hydroxy-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 114263707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).