2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone

C13H19N3O2 — CID 170895839

IUPAC2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone
SMILESCN(C)CC(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C13H19N3O2/c1-15(2)10-12(17)11-3-4-13(14-9-11)16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3
InChIKeyWNKLEDBBMMQJNT-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.66
Rot. Bonds4

About 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone

2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone (PubChem CID 170895839) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone.

Molecular Properties

Compound Name2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone
PubChem CID170895839
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone
SMILESCN(C)CC(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C13H19N3O2/c1-15(2)10-12(17)11-3-4-13(14-9-11)16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3
InChIKeyWNKLEDBBMMQJNT-UHFFFAOYSA-N
XLogP0.66
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;1-(6-morpholin-4-yl-3-pyridinyl)ethanone
CID 145421407
N-(4-hydroxyphenyl)-N-methyl-6-morpholin-4-ylpyridine-3-carboxamide
CID 84570914
N-methyl-N-(4-methylcyclohexyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 47018145
N-methyl-6-morpholin-4-yl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 18163518
N,N-dimethyl-4-(6-morpholin-4-ylpyridine-3-carbonyl)piperazine-1-sulfonamide
CID 32505460
N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-6-morpholin-4-ylpyridine-3-carboxamide
CID 46560073
N-methyl-6-morpholin-4-yl-N-(naphthalen-2-ylmethyl)pyridine-3-carboxamide
CID 18133785
6-morpholin-4-yl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 18142338
N-methyl-N-[2-(2-methylphenoxy)ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 18142801
1-[6-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]propan-1-one
CID 166604192
N'-(4-fluorobenzoyl)-6-morpholin-4-ylpyridine-3-carbohydrazide
CID 46697479
(4-acetamidophenyl) 6-morpholin-4-ylpyridine-3-carboxylate
CID 37325010

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone?
The IUPAC name of 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone (CID 170895839) is 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone.
What is the SMILES notation for 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone?
The canonical SMILES for 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone is CN(C)CC(=O)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone?
The InChIKey is WNKLEDBBMMQJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-15(2)10-12(17)11-3-4-13(14-9-11)16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone?
2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone has a molecular weight of 249.31 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(6-morpholin-4-yl-3-pyridinyl)ethanone is sourced from PubChem (CID 170895839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).