4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide

C13H20N4O3 — CID 133430656

IUPAC4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide
SMILESCCOc1cncc(NCC2(C(N)=O)CCOCC2)n1
InChIInChI=1S/C13H20N4O3/c1-2-20-11-8-15-7-10(17-11)16-9-13(12(14)18)3-5-19-6-4-13/h7-8H,2-6,9H2,1H3,(H2,14,18)(H,16,17)
InChIKeyUKTFHIRPDJJQAP-UHFFFAOYSA-N
MW280.33 g/mol
LogP0.57
Rot. Bonds6

About 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide

4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide (PubChem CID 133430656) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide.

Molecular Properties

Compound Name4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide
PubChem CID133430656
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide
SMILESCCOc1cncc(NCC2(C(N)=O)CCOCC2)n1
InChIInChI=1S/C13H20N4O3/c1-2-20-11-8-15-7-10(17-11)16-9-13(12(14)18)3-5-19-6-4-13/h7-8H,2-6,9H2,1H3,(H2,14,18)(H,16,17)
InChIKeyUKTFHIRPDJJQAP-UHFFFAOYSA-N
XLogP0.57
TPSA99.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-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

4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxylic acid
CID 115438674
4-[[(6-propoxypyrazin-2-yl)amino]methyl]oxane-4-carboxylic acid
CID 115438744
1-[[(6-ethoxypyrazin-2-yl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115450341
3-[(6-ethoxypyrazin-2-yl)amino]oxolane-3-carboxylic acid
CID 64889450
4-[[(6-methylpyrimidin-4-yl)amino]methyl]oxane-4-carboxamide
CID 133314301
1-[[(6-propoxypyrazin-2-yl)amino]methyl]cyclohexane-1-carboxylic acid
CID 115436121
1-[[(6-methoxypyrazin-2-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 113309144
(6-ethoxypyrazin-2-yl)thiourea
CID 90714777
4-[[(3-chloro-4-pyridinyl)amino]methyl]oxane-4-carboxamide
CID 84595497
2-[1-[(6-ethoxypyrazin-2-yl)amino]cyclohexyl]acetic acid
CID 64701575
4-[(6-methoxypyrazin-2-yl)amino]oxane-4-carboxylic acid
CID 113280252
2-[1-[[(6-propoxypyrazin-2-yl)amino]methyl]cyclobutyl]acetic acid
CID 81162308

Frequently Asked Questions

What is the IUPAC name of 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide?
The IUPAC name of 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide (CID 133430656) is 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide.
What is the SMILES notation for 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide?
The canonical SMILES for 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide is CCOc1cncc(NCC2(C(N)=O)CCOCC2)n1.
What is the InChIKey of 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide?
The InChIKey is UKTFHIRPDJJQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-2-20-11-8-15-7-10(17-11)16-9-13(12(14)18)3-5-19-6-4-13/h7-8H,2-6,9H2,1H3,(H2,14,18)(H,16,17).
What are the key properties of 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide?
4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(6-ethoxypyrazin-2-yl)amino]methyl]oxane-4-carboxamide is sourced from PubChem (CID 133430656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).