N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide

C16H18N4O3 — CID 39231127

IUPACN-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide
SMILESCOCCNC(=O)Cc1ccc(NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H18N4O3/c1-23-9-8-19-15(21)10-12-2-4-13(5-3-12)20-16(22)14-11-17-6-7-18-14/h2-7,11H,8-10H2,1H3,(H,19,21)(H,20,22)
InChIKeyNHEMKPIGZRLWFE-UHFFFAOYSA-N
MW314.35 g/mol
LogP1.03
Rot. Bonds7

About N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide

N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide (PubChem CID 39231127) has the molecular formula C16H18N4O3 and a molecular weight of 314.35 g/mol. Its IUPAC name is N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide
PubChem CID39231127
Molecular FormulaC16H18N4O3
Molecular Weight314.35 g/mol
Exact Mass314.14
IUPAC NameN-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide
SMILESCOCCNC(=O)Cc1ccc(NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H18N4O3/c1-23-9-8-19-15(21)10-12-2-4-13(5-3-12)20-16(22)14-11-17-6-7-18-14/h2-7,11H,8-10H2,1H3,(H,19,21)(H,20,22)
InChIKeyNHEMKPIGZRLWFE-UHFFFAOYSA-N
XLogP1.03
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-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

N-[6-(2-methoxyethoxy)-3-pyridinyl]pyrazine-2-carboxamide
CID 43069859
N-[2-[[2-(4-chlorophenyl)acetyl]amino]ethyl]pyrazine-2-carboxamide
CID 6498574
[2-(2-methoxyethylamino)-2-oxoethyl] pyrazine-2-carboxylate
CID 7702375
N-(4-acetylphenyl)pyrazine-2-carboxamide
CID 803592
N-[4-(sulfamoylmethyl)phenyl]pyrazine-2-carboxamide
CID 60715551
N-(2-methoxyethyl)-2-pyridin-3-ylacetamide
CID 110697049
N-(4-sulfanylphenyl)pyrazine-2-carboxamide
CID 137223268
N-(4-aminophenyl)pyrazine-2-carboxamide
CID 16775114
N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]-2,2-diphenylacetamide
CID 39231113
N-(2-methoxyethyl)-2-(pyrazin-2-ylamino)acetamide
CID 115574127
N-(3-bromo-4-methylphenyl)pyrazine-2-carboxamide
CID 110699072
N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]cyclobutanecarboxamide
CID 39231121

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide (CID 39231127) is N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide is COCCNC(=O)Cc1ccc(NC(=O)c2cnccn2)cc1.
What is the InChIKey of N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide?
The InChIKey is NHEMKPIGZRLWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c1-23-9-8-19-15(21)10-12-2-4-13(5-3-12)20-16(22)14-11-17-6-7-18-14/h2-7,11H,8-10H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide?
N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide has a molecular weight of 314.35 g/mol, XLogP of 1.03, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 39231127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).