4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide

C16H24N2O2 — CID 103956839

IUPAC4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
SMILESCc1cc(C(=O)NCCC2CCN(C)CC2)ccc1O
InChIInChI=1S/C16H24N2O2/c1-12-11-14(3-4-15(12)19)16(20)17-8-5-13-6-9-18(2)10-7-13/h3-4,11,13,19H,5-10H2,1-2H3,(H,17,20)
InChIKeyBWVYKDLVLJAGRL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.16
Rot. Bonds4

About 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide

4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide (PubChem CID 103956839) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
PubChem CID103956839
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
SMILESCc1cc(C(=O)NCCC2CCN(C)CC2)ccc1O
InChIInChI=1S/C16H24N2O2/c1-12-11-14(3-4-15(12)19)16(20)17-8-5-13-6-9-18(2)10-7-13/h3-4,11,13,19H,5-10H2,1-2H3,(H,17,20)
InChIKeyBWVYKDLVLJAGRL-UHFFFAOYSA-N
XLogP2.16
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The IUPAC name of 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide (CID 103956839) is 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The canonical SMILES for 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide is Cc1cc(C(=O)NCCC2CCN(C)CC2)ccc1O.
What is the InChIKey of 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The InChIKey is BWVYKDLVLJAGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-11-14(3-4-15(12)19)16(20)17-8-5-13-6-9-18(2)10-7-13/h3-4,11,13,19H,5-10H2,1-2H3,(H,17,20).
What are the key properties of 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide is sourced from PubChem (CID 103956839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).