4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide

C13H20N4O2 — CID 83095840

IUPAC4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
SMILESCCNc1ncccc1CN1CCOCC1C(N)=O
InChIInChI=1S/C13H20N4O2/c1-2-15-13-10(4-3-5-16-13)8-17-6-7-19-9-11(17)12(14)18/h3-5,11H,2,6-9H2,1H3,(H2,14,18)(H,15,16)
InChIKeyGLFRNUZZPCKXAG-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.20
Rot. Bonds5

About 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide

4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide (PubChem CID 83095840) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
PubChem CID83095840
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
SMILESCCNc1ncccc1CN1CCOCC1C(N)=O
InChIInChI=1S/C13H20N4O2/c1-2-15-13-10(4-3-5-16-13)8-17-6-7-19-9-11(17)12(14)18/h3-5,11H,2,6-9H2,1H3,(H2,14,18)(H,15,16)
InChIKeyGLFRNUZZPCKXAG-UHFFFAOYSA-N
XLogP0.20
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The IUPAC name of 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide (CID 83095840) is 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide is CCNc1ncccc1CN1CCOCC1C(N)=O.
What is the InChIKey of 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The InChIKey is GLFRNUZZPCKXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-15-13-10(4-3-5-16-13)8-17-6-7-19-9-11(17)12(14)18/h3-5,11H,2,6-9H2,1H3,(H2,14,18)(H,15,16).
What are the key properties of 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide is sourced from PubChem (CID 83095840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).