2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide

C14H18N2O4 — CID 64668039

IUPAC2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
SMILESCOc1ccc(O)c(C(=O)NC2CCC(=O)N(C)C2)c1
InChIInChI=1S/C14H18N2O4/c1-16-8-9(3-6-13(16)18)15-14(19)11-7-10(20-2)4-5-12(11)17/h4-5,7,9,17H,3,6,8H2,1-2H3,(H,15,19)
InChIKeyVLDSLFFFZANIQG-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.75
Rot. Bonds3

About 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide

2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide (PubChem CID 64668039) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
PubChem CID64668039
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
SMILESCOc1ccc(O)c(C(=O)NC2CCC(=O)N(C)C2)c1
InChIInChI=1S/C14H18N2O4/c1-16-8-9(3-6-13(16)18)15-14(19)11-7-10(20-2)4-5-12(11)17/h4-5,7,9,17H,3,6,8H2,1-2H3,(H,15,19)
InChIKeyVLDSLFFFZANIQG-UHFFFAOYSA-N
XLogP0.75
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The IUPAC name of 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide (CID 64668039) is 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide.
What is the SMILES notation for 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The canonical SMILES for 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide is COc1ccc(O)c(C(=O)NC2CCC(=O)N(C)C2)c1.
What is the InChIKey of 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The InChIKey is VLDSLFFFZANIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-16-8-9(3-6-13(16)18)15-14(19)11-7-10(20-2)4-5-12(11)17/h4-5,7,9,17H,3,6,8H2,1-2H3,(H,15,19).
What are the key properties of 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide has a molecular weight of 278.31 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide is sourced from PubChem (CID 64668039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).