[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone

C16H25N3O2 — CID 81237248

IUPAC[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone
SMILESCCNc1cc(C)ncc1C(=O)N1CC(C)OCC1CC
InChIInChI=1S/C16H25N3O2/c1-5-13-10-21-12(4)9-19(13)16(20)14-8-18-11(3)7-15(14)17-6-2/h7-8,12-13H,5-6,9-10H2,1-4H3,(H,17,18)
InChIKeyWGPCNVYJKAXGOJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.46
Rot. Bonds4

About [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone

[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone (PubChem CID 81237248) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone
PubChem CID81237248
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone
SMILESCCNc1cc(C)ncc1C(=O)N1CC(C)OCC1CC
InChIInChI=1S/C16H25N3O2/c1-5-13-10-21-12(4)9-19(13)16(20)14-8-18-11(3)7-15(14)17-6-2/h7-8,12-13H,5-6,9-10H2,1-4H3,(H,17,18)
InChIKeyWGPCNVYJKAXGOJ-UHFFFAOYSA-N
XLogP2.46
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The IUPAC name of [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone (CID 81237248) is [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The canonical SMILES for [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone is CCNc1cc(C)ncc1C(=O)N1CC(C)OCC1CC.
What is the InChIKey of [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The InChIKey is WGPCNVYJKAXGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-5-13-10-21-12(4)9-19(13)16(20)14-8-18-11(3)7-15(14)17-6-2/h7-8,12-13H,5-6,9-10H2,1-4H3,(H,17,18).
What are the key properties of [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone?
[4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone has a molecular weight of 291.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)-6-methyl-3-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 81237248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).