2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one

C22H28N2O4 — CID 88511155

IUPAC2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one
SMILESO=c1cc(-c2ccc(OCCC3CCNCC3)cc2)oc(N2CCOCC2)c1
InChIInChI=1S/C22H28N2O4/c25-19-15-21(28-22(16-19)24-10-13-26-14-11-24)18-1-3-20(4-2-18)27-12-7-17-5-8-23-9-6-17/h1-4,15-17,23H,5-14H2
InChIKeyUFNYVPYWZPNVKT-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.91
Rot. Bonds6

About 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one

2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one (PubChem CID 88511155) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one
PubChem CID88511155
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one
SMILESO=c1cc(-c2ccc(OCCC3CCNCC3)cc2)oc(N2CCOCC2)c1
InChIInChI=1S/C22H28N2O4/c25-19-15-21(28-22(16-19)24-10-13-26-14-11-24)18-1-3-20(4-2-18)27-12-7-17-5-8-23-9-6-17/h1-4,15-17,23H,5-14H2
InChIKeyUFNYVPYWZPNVKT-UHFFFAOYSA-N
XLogP2.91
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one?
The IUPAC name of 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one (CID 88511155) is 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one.
What is the SMILES notation for 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one?
The canonical SMILES for 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one is O=c1cc(-c2ccc(OCCC3CCNCC3)cc2)oc(N2CCOCC2)c1.
What is the InChIKey of 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one?
The InChIKey is UFNYVPYWZPNVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c25-19-15-21(28-22(16-19)24-10-13-26-14-11-24)18-1-3-20(4-2-18)27-12-7-17-5-8-23-9-6-17/h1-4,15-17,23H,5-14H2.
What are the key properties of 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one?
2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one has a molecular weight of 384.48 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-6-[4-(2-piperidin-4-ylethoxy)phenyl]pyran-4-one is sourced from PubChem (CID 88511155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).