2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone

C18H26N2O4 — CID 74576696

IUPAC2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone
SMILESCCC1CN(C(=O)c2ccco2)CCC1CC(=O)N1CCOCC1
InChIInChI=1S/C18H26N2O4/c1-2-14-13-20(18(22)16-4-3-9-24-16)6-5-15(14)12-17(21)19-7-10-23-11-8-19/h3-4,9,14-15H,2,5-8,10-13H2,1H3
InChIKeyKIHCPRAWBCEYHC-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.02
Rot. Bonds4

About 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone

2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone (PubChem CID 74576696) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone
PubChem CID74576696
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC Name2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone
SMILESCCC1CN(C(=O)c2ccco2)CCC1CC(=O)N1CCOCC1
InChIInChI=1S/C18H26N2O4/c1-2-14-13-20(18(22)16-4-3-9-24-16)6-5-15(14)12-17(21)19-7-10-23-11-8-19/h3-4,9,14-15H,2,5-8,10-13H2,1H3
InChIKeyKIHCPRAWBCEYHC-UHFFFAOYSA-N
XLogP2.02
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3S,4S)-3-ethyl-1-(4-fluorobenzoyl)piperidin-4-yl]-1-morpholin-4-ylethanone
CID 162966907
2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-N-phenylacetamide
CID 73138876
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(furan-2-yl)methanone
CID 114506827
1-[4-(furan-2-carbonyl)piperazin-1-yl]-3-morpholin-4-ylpropane-1,3-dione
CID 108943477
2-[(3R,4S)-3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 11911985
2-(1-benzoyl-3-ethylpiperidin-4-yl)-1-(4-hydroxypiperidin-1-yl)ethanone
CID 73148945
furan-2-yl-(3-propan-2-ylpyrrolidin-1-yl)methanone
CID 115686874
(3S)-1-(furan-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 94917226
furan-2-yl-(3-methylsulfonylpyrrolidin-1-yl)methanone
CID 71805486
[1-(furan-2-carbonyl)pyrrolidin-3-yl]methanesulfonamide
CID 118788568
[(3R,4R)-3-benzyl-4-methoxypiperidin-1-yl]-(furan-2-yl)methanone
CID 124790949
1-(furan-2-carbonyl)piperidine-3,4-dicarboxylic acid
CID 112568035

Frequently Asked Questions

What is the IUPAC name of 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone (CID 74576696) is 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone is CCC1CN(C(=O)c2ccco2)CCC1CC(=O)N1CCOCC1.
What is the InChIKey of 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone?
The InChIKey is KIHCPRAWBCEYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-2-14-13-20(18(22)16-4-3-9-24-16)6-5-15(14)12-17(21)19-7-10-23-11-8-19/h3-4,9,14-15H,2,5-8,10-13H2,1H3.
What are the key properties of 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone?
2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone has a molecular weight of 334.42 g/mol, XLogP of 2.02, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-ethyl-1-(furan-2-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 74576696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).