N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide

C15H22N2O2 — CID 55002980

IUPACN-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide
SMILESCCN1CCC(N(C)C(=O)c2ccccc2O)CC1
InChIInChI=1S/C15H22N2O2/c1-3-17-10-8-12(9-11-17)16(2)15(19)13-6-4-5-7-14(13)18/h4-7,12,18H,3,8-11H2,1-2H3
InChIKeyADLKYSOBBVGVBV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.95
Rot. Bonds3

About N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide

N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide (PubChem CID 55002980) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide
PubChem CID55002980
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide
SMILESCCN1CCC(N(C)C(=O)c2ccccc2O)CC1
InChIInChI=1S/C15H22N2O2/c1-3-17-10-8-12(9-11-17)16(2)15(19)13-6-4-5-7-14(13)18/h4-7,12,18H,3,8-11H2,1-2H3
InChIKeyADLKYSOBBVGVBV-UHFFFAOYSA-N
XLogP1.95
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide (CID 55002980) is N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide is CCN1CCC(N(C)C(=O)c2ccccc2O)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide?
The InChIKey is ADLKYSOBBVGVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-17-10-8-12(9-11-17)16(2)15(19)13-6-4-5-7-14(13)18/h4-7,12,18H,3,8-11H2,1-2H3.
What are the key properties of N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide?
N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide is sourced from PubChem (CID 55002980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).