1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one

C12H16N2O2 — CID 116595828

IUPAC1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one
SMILESO=C(Cc1ccccn1)CC1COCCN1
InChIInChI=1S/C12H16N2O2/c15-12(7-10-3-1-2-4-13-10)8-11-9-16-6-5-14-11/h1-4,11,14H,5-9H2
InChIKeyRHXMGAOHVGUPFF-UHFFFAOYSA-N
MW220.27 g/mol
LogP0.57
Rot. Bonds4

About 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one

1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one (PubChem CID 116595828) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one.

Molecular Properties

Compound Name1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one
PubChem CID116595828
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one
SMILESO=C(Cc1ccccn1)CC1COCCN1
InChIInChI=1S/C12H16N2O2/c15-12(7-10-3-1-2-4-13-10)8-11-9-16-6-5-14-11/h1-4,11,14H,5-9H2
InChIKeyRHXMGAOHVGUPFF-UHFFFAOYSA-N
XLogP0.57
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-morpholin-3-yl-3-pyridin-4-ylpropan-2-one
CID 116595856
1-(1-methylimidazol-2-yl)-3-morpholin-3-ylpropan-2-one
CID 116595774
N-(morpholin-3-ylmethyl)-2-pyridin-2-ylethanesulfonamide
CID 103548911
2-[(3R)-morpholin-3-yl]-1-phenylethanone
CID 95396636
2-morpholin-3-yl-1-phenylethanone
CID 14753828
1-(2,5-difluorophenyl)-3-morpholin-3-ylpropan-2-one
CID 116595683
N-(2-pyridin-2-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119827893
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-pyridin-2-ylpropan-2-one
CID 66417796
2-morpholin-3-yl-1-pyridin-3-ylethanone
CID 115777328
1-(4-methyl-1,3-thiazol-2-yl)-3-morpholin-3-ylpropan-2-one
CID 116595810
2-methyl-N-(morpholin-3-ylmethyl)-2-pyridin-2-ylpropan-1-amine
CID 115238220
1-(8-azabicyclo[3.2.1]octan-3-yl)-3-pyridin-2-ylpropan-2-one
CID 116588427

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one?
The IUPAC name of 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one (CID 116595828) is 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one.
What is the SMILES notation for 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one?
The canonical SMILES for 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one is O=C(Cc1ccccn1)CC1COCCN1.
What is the InChIKey of 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one?
The InChIKey is RHXMGAOHVGUPFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-12(7-10-3-1-2-4-13-10)8-11-9-16-6-5-14-11/h1-4,11,14H,5-9H2.
What are the key properties of 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one?
1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one has a molecular weight of 220.27 g/mol, XLogP of 0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-3-yl-3-pyridin-2-ylpropan-2-one is sourced from PubChem (CID 116595828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).