1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one

C11H16N2O2 — CID 116591647

IUPAC1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one
SMILESCOCCNCC(=O)Cc1ccccn1
InChIInChI=1S/C11H16N2O2/c1-15-7-6-12-9-11(14)8-10-4-2-3-5-13-10/h2-5,12H,6-9H2,1H3
InChIKeySULYVCQINGRYRL-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.43
Rot. Bonds7

About 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one

1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one (PubChem CID 116591647) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one.

Molecular Properties

Compound Name1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one
PubChem CID116591647
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one
SMILESCOCCNCC(=O)Cc1ccccn1
InChIInChI=1S/C11H16N2O2/c1-15-7-6-12-9-11(14)8-10-4-2-3-5-13-10/h2-5,12H,6-9H2,1H3
InChIKeySULYVCQINGRYRL-UHFFFAOYSA-N
XLogP0.43
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-2-(2-methoxyethylamino)-N-(pyridin-2-ylmethyl)acetamide
CID 79281792
1-(prop-2-enylamino)-3-pyridin-2-ylpropan-2-one
CID 116589890
1-(2,6-difluorophenyl)-3-(2-methoxyethylamino)propan-2-one
CID 114935457
methyl 2-oxo-3-pyridin-2-ylpropanoate
CID 13353658
N-(3-methoxypropyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 60647529
1-(2,3-dichlorophenyl)-3-(2-methoxyethylamino)propan-2-one
CID 107311411
tris[2-(2-methoxyethoxy)ethoxy]methyl 2-pyridin-2-ylacetate
CID 69399075
5-(methylamino)-1-pyridin-2-ylpentan-2-one
CID 116555736
N-(2-methoxyethyl)-5-pyridin-2-ylpent-3-en-1-amine
CID 79598410
1-(3,4-dichlorophenyl)-3-(2-methoxyethylamino)propan-2-one
CID 116591432
2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine
CID 63058176
4-methylidene-1-pyridin-2-ylhexan-2-one
CID 66045043

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one?
The IUPAC name of 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one (CID 116591647) is 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one.
What is the SMILES notation for 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one?
The canonical SMILES for 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one is COCCNCC(=O)Cc1ccccn1.
What is the InChIKey of 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one?
The InChIKey is SULYVCQINGRYRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-15-7-6-12-9-11(14)8-10-4-2-3-5-13-10/h2-5,12H,6-9H2,1H3.
What are the key properties of 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one?
1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one has a molecular weight of 208.26 g/mol, XLogP of 0.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethylamino)-3-pyridin-2-ylpropan-2-one is sourced from PubChem (CID 116591647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).