1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone

C11H18N2O2 — CID 117125596

IUPAC1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone
SMILESO=C(CC1=CCNCC1)N1CCOCC1
InChIInChI=1S/C11H18N2O2/c14-11(13-5-7-15-8-6-13)9-10-1-3-12-4-2-10/h1,12H,2-9H2
InChIKeyBPBHUPBBBALIDC-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.16
Rot. Bonds2

About 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone

1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone (PubChem CID 117125596) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone
PubChem CID117125596
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone
SMILESO=C(CC1=CCNCC1)N1CCOCC1
InChIInChI=1S/C11H18N2O2/c14-11(13-5-7-15-8-6-13)9-10-1-3-12-4-2-10/h1,12H,2-9H2
InChIKeyBPBHUPBBBALIDC-UHFFFAOYSA-N
XLogP0.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-fluorophenyl)-1-[4-(morpholine-4-carbonyl)piperazin-1-yl]ethanone
CID 110365721
2-(3,4-dichlorophenyl)-1-morpholin-4-ylethanone
CID 1485657
2-(2,5-dimethyl-1H-pyrrol-3-yl)-1-morpholin-4-ylethanone
CID 110773449
3-[1-[2-(cyclohexen-1-yl)acetyl]piperidin-3-yl]-1-morpholin-4-ylpropan-1-one
CID 45229164
2-(4-fluorophenyl)sulfonyl-1-morpholin-4-ylethanone
CID 1486407
1-morpholin-4-yl-2-(4-nitrophenyl)ethanone
CID 5170165
1-morpholin-4-yl-2-(4-phenoxyphenyl)ethanone
CID 110768044
2-(4-amino-3-hydroxyphenyl)-1-morpholin-4-ylethanone
CID 69370465
1-morpholin-4-yl-3-piperazin-1-ylpropan-1-one;dihydrochloride
CID 53415361
2-(4-cyclohexylphenyl)-1-morpholin-4-ylethanone
CID 110767551
1-morpholin-4-yl-2-(4-propan-2-ylsulfonylphenyl)ethanone
CID 16838369
1-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one
CID 62311600

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone (CID 117125596) is 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone is O=C(CC1=CCNCC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone?
The InChIKey is BPBHUPBBBALIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c14-11(13-5-7-15-8-6-13)9-10-1-3-12-4-2-10/h1,12H,2-9H2.
What are the key properties of 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone?
1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone has a molecular weight of 210.28 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)ethanone is sourced from PubChem (CID 117125596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).