4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one

C22H30N2O4 — CID 54703747

IUPAC4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one
SMILESCOCCn1c(C)cc(O)c(C(c2ccc(OC)cc2)N2CCCCC2)c1=O
InChIInChI=1S/C22H30N2O4/c1-16-15-19(25)20(22(26)24(16)13-14-27-2)21(23-11-5-4-6-12-23)17-7-9-18(28-3)10-8-17/h7-10,15,21,25H,4-6,11-14H2,1-3H3
InChIKeyUKXNQBWEXOYXIV-UHFFFAOYSA-N
MW386.49 g/mol
LogP3.09
Rot. Bonds7

About 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one

4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one (PubChem CID 54703747) has the molecular formula C22H30N2O4 and a molecular weight of 386.49 g/mol. Its IUPAC name is 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one
PubChem CID54703747
Molecular FormulaC22H30N2O4
Molecular Weight386.49 g/mol
Exact Mass386.22
IUPAC Name4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one
SMILESCOCCn1c(C)cc(O)c(C(c2ccc(OC)cc2)N2CCCCC2)c1=O
InChIInChI=1S/C22H30N2O4/c1-16-15-19(25)20(22(26)24(16)13-14-27-2)21(23-11-5-4-6-12-23)17-7-9-18(28-3)10-8-17/h7-10,15,21,25H,4-6,11-14H2,1-3H3
InChIKeyUKXNQBWEXOYXIV-UHFFFAOYSA-N
XLogP3.09
TPSA63.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.49
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one?
The IUPAC name of 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one (CID 54703747) is 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one.
What is the SMILES notation for 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one?
The canonical SMILES for 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one is COCCn1c(C)cc(O)c(C(c2ccc(OC)cc2)N2CCCCC2)c1=O.
What is the InChIKey of 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one?
The InChIKey is UKXNQBWEXOYXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O4/c1-16-15-19(25)20(22(26)24(16)13-14-27-2)21(23-11-5-4-6-12-23)17-7-9-18(28-3)10-8-17/h7-10,15,21,25H,4-6,11-14H2,1-3H3.
What are the key properties of 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one?
4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one has a molecular weight of 386.49 g/mol, XLogP of 3.09, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(2-methoxyethyl)-3-[(4-methoxyphenyl)-piperidin-1-ylmethyl]-6-methylpyridin-2-one is sourced from PubChem (CID 54703747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).