N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide

C19H23N3O3 — CID 136523951

IUPACN-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1ccccc1N1CCC(NC(=O)c2cccn(C)c2=O)CC1
InChIInChI=1S/C19H23N3O3/c1-21-11-5-6-15(19(21)24)18(23)20-14-9-12-22(13-10-14)16-7-3-4-8-17(16)25-2/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,20,23)
InChIKeyNPHVMGGRUMDUKD-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.79
Rot. Bonds4

About N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide

N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide (PubChem CID 136523951) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide
PubChem CID136523951
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide
SMILESCOc1ccccc1N1CCC(NC(=O)c2cccn(C)c2=O)CC1
InChIInChI=1S/C19H23N3O3/c1-21-11-5-6-15(19(21)24)18(23)20-14-9-12-22(13-10-14)16-7-3-4-8-17(16)25-2/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,20,23)
InChIKeyNPHVMGGRUMDUKD-UHFFFAOYSA-N
XLogP1.79
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide (CID 136523951) is N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide is COc1ccccc1N1CCC(NC(=O)c2cccn(C)c2=O)CC1.
What is the InChIKey of N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is NPHVMGGRUMDUKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-21-11-5-6-15(19(21)24)18(23)20-14-9-12-22(13-10-14)16-7-3-4-8-17(16)25-2/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,20,23).
What are the key properties of N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide?
N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)piperidin-4-yl]-1-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 136523951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).