2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide

C14H20N2O3 — CID 107585188

IUPAC2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CNCC(C)C2)c1O
InChIInChI=1S/C14H20N2O3/c1-9-6-10(8-15-7-9)16-14(18)11-4-3-5-12(19-2)13(11)17/h3-5,9-10,15,17H,6-8H2,1-2H3,(H,16,18)
InChIKeyPTXBBJDMMNKVLD-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.13
Rot. Bonds3

About 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide

2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide (PubChem CID 107585188) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide
PubChem CID107585188
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CNCC(C)C2)c1O
InChIInChI=1S/C14H20N2O3/c1-9-6-10(8-15-7-9)16-14(18)11-4-3-5-12(19-2)13(11)17/h3-5,9-10,15,17H,6-8H2,1-2H3,(H,16,18)
InChIKeyPTXBBJDMMNKVLD-UHFFFAOYSA-N
XLogP1.13
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide?
The IUPAC name of 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide (CID 107585188) is 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide.
What is the SMILES notation for 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide?
The canonical SMILES for 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide is COc1cccc(C(=O)NC2CNCC(C)C2)c1O.
What is the InChIKey of 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide?
The InChIKey is PTXBBJDMMNKVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9-6-10(8-15-7-9)16-14(18)11-4-3-5-12(19-2)13(11)17/h3-5,9-10,15,17H,6-8H2,1-2H3,(H,16,18).
What are the key properties of 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide?
2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.13, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide is sourced from PubChem (CID 107585188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).