2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone

C14H22N4O2 — CID 110132346

IUPAC2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone
SMILESCNCC(=O)N1CCOCC1CCc1nccnc1C
InChIInChI=1S/C14H22N4O2/c1-11-13(17-6-5-16-11)4-3-12-10-20-8-7-18(12)14(19)9-15-2/h5-6,12,15H,3-4,7-10H2,1-2H3
InChIKeyCYLSXDARONCJQB-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.16
Rot. Bonds5

About 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone

2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone (PubChem CID 110132346) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone
PubChem CID110132346
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone
SMILESCNCC(=O)N1CCOCC1CCc1nccnc1C
InChIInChI=1S/C14H22N4O2/c1-11-13(17-6-5-16-11)4-3-12-10-20-8-7-18(12)14(19)9-15-2/h5-6,12,15H,3-4,7-10H2,1-2H3
InChIKeyCYLSXDARONCJQB-UHFFFAOYSA-N
XLogP0.16
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone?
The IUPAC name of 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone (CID 110132346) is 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone?
The canonical SMILES for 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone is CNCC(=O)N1CCOCC1CCc1nccnc1C.
What is the InChIKey of 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone?
The InChIKey is CYLSXDARONCJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-11-13(17-6-5-16-11)4-3-12-10-20-8-7-18(12)14(19)9-15-2/h5-6,12,15H,3-4,7-10H2,1-2H3.
What are the key properties of 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone?
2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone has a molecular weight of 278.36 g/mol, XLogP of 0.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-1-[3-[2-(3-methylpyrazin-2-yl)ethyl]morpholin-4-yl]ethanone is sourced from PubChem (CID 110132346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).