4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide

C12H19N5O2 — CID 83106116

IUPAC4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide
SMILESCCNc1nc(C)cc(N2CCOCC2C(N)=O)n1
InChIInChI=1S/C12H19N5O2/c1-3-14-12-15-8(2)6-10(16-12)17-4-5-19-7-9(17)11(13)18/h6,9H,3-5,7H2,1-2H3,(H2,13,18)(H,14,15,16)
InChIKeyUYCFUTAVGVBBIV-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.09
Rot. Bonds4

About 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide

4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide (PubChem CID 83106116) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide
PubChem CID83106116
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide
SMILESCCNc1nc(C)cc(N2CCOCC2C(N)=O)n1
InChIInChI=1S/C12H19N5O2/c1-3-14-12-15-8(2)6-10(16-12)17-4-5-19-7-9(17)11(13)18/h6,9H,3-5,7H2,1-2H3,(H2,13,18)(H,14,15,16)
InChIKeyUYCFUTAVGVBBIV-UHFFFAOYSA-N
XLogP-0.09
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide?
The IUPAC name of 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide (CID 83106116) is 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide?
The canonical SMILES for 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide is CCNc1nc(C)cc(N2CCOCC2C(N)=O)n1.
What is the InChIKey of 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide?
The InChIKey is UYCFUTAVGVBBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-3-14-12-15-8(2)6-10(16-12)17-4-5-19-7-9(17)11(13)18/h6,9H,3-5,7H2,1-2H3,(H2,13,18)(H,14,15,16).
What are the key properties of 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide?
4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(ethylamino)-6-methylpyrimidin-4-yl]morpholine-3-carboxamide is sourced from PubChem (CID 83106116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).