[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone

C13H19N3O2 — CID 62167827

IUPAC[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone
SMILESCCNc1ccnc(C(=O)N2CCOCC2C)c1
InChIInChI=1S/C13H19N3O2/c1-3-14-11-4-5-15-12(8-11)13(17)16-6-7-18-9-10(16)2/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,14,15)
InChIKeyWSHSXYZUFSNKCQ-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.37
Rot. Bonds3

About [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone

[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone (PubChem CID 62167827) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone
PubChem CID62167827
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone
SMILESCCNc1ccnc(C(=O)N2CCOCC2C)c1
InChIInChI=1S/C13H19N3O2/c1-3-14-11-4-5-15-12(8-11)13(17)16-6-7-18-9-10(16)2/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,14,15)
InChIKeyWSHSXYZUFSNKCQ-UHFFFAOYSA-N
XLogP1.37
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(ethylamino)-2-pyridinyl]-(3-ethylmorpholin-4-yl)methanone
CID 55047074
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[4-(ethylamino)-2-pyridinyl]methanone
CID 104960428
[4-(ethylamino)-2-pyridinyl]-[2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 62175903
2-azabicyclo[2.2.1]heptan-2-yl-[4-(ethylamino)-2-pyridinyl]methanone
CID 62173507
[4-(ethylamino)-2-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
CID 63604449
[2-(methylamino)-4-pyridinyl]-(3-methylmorpholin-4-yl)methanone
CID 55047498
[4-(dimethylamino)piperidin-1-yl]-[4-(ethylamino)-2-pyridinyl]methanone
CID 62169404
(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone
CID 62169207
(2-bromo-4-pyridinyl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106832524
[4-(ethylamino)-2-pyridinyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 62168232
[4-(ethylamino)-2-pyridinyl]-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone
CID 103358193
(4-chloro-1H-pyrrol-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 94145769

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone (CID 62167827) is [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone is CCNc1ccnc(C(=O)N2CCOCC2C)c1.
What is the InChIKey of [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The InChIKey is WSHSXYZUFSNKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-14-11-4-5-15-12(8-11)13(17)16-6-7-18-9-10(16)2/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,14,15).
What are the key properties of [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
[4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone has a molecular weight of 249.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)-2-pyridinyl]-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 62167827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).