[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone

C18H24N2O4 — CID 801159

IUPAC[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCOc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1
InChIInChI=1S/C18H24N2O4/c1-23-16-4-2-14(3-5-16)17(21)19-8-6-15(7-9-19)18(22)20-10-12-24-13-11-20/h2-5,15H,6-13H2,1H3
InChIKeyYJXPLXAHPQGELW-UHFFFAOYSA-N
MW332.40 g/mol
LogP1.41
Rot. Bonds3

About [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone

[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 801159) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID801159
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCOc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1
InChIInChI=1S/C18H24N2O4/c1-23-16-4-2-14(3-5-16)17(21)19-8-6-15(7-9-19)18(22)20-10-12-24-13-11-20/h2-5,15H,6-13H2,1H3
InChIKeyYJXPLXAHPQGELW-UHFFFAOYSA-N
XLogP1.41
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone (CID 801159) is [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone is COc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1.
What is the InChIKey of [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is YJXPLXAHPQGELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-23-16-4-2-14(3-5-16)17(21)19-8-6-15(7-9-19)18(22)20-10-12-24-13-11-20/h2-5,15H,6-13H2,1H3.
What are the key properties of [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
[1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 332.40 g/mol, XLogP of 1.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 801159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).