4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide

C15H22N2O2 — CID 111106900

IUPAC4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide
SMILESCC(O)C1CCCCN1Cc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H22N2O2/c1-11(18)14-4-2-3-9-17(14)10-12-5-7-13(8-6-12)15(16)19/h5-8,11,14,18H,2-4,9-10H2,1H3,(H2,16,19)
InChIKeyBMHXQPSUTZBAOA-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.52
Rot. Bonds4

About 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide

4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide (PubChem CID 111106900) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide.

Molecular Properties

Compound Name4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide
PubChem CID111106900
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide
SMILESCC(O)C1CCCCN1Cc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H22N2O2/c1-11(18)14-4-2-3-9-17(14)10-12-5-7-13(8-6-12)15(16)19/h5-8,11,14,18H,2-4,9-10H2,1H3,(H2,16,19)
InChIKeyBMHXQPSUTZBAOA-UHFFFAOYSA-N
XLogP1.52
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
CID 111106746
(1R)-1-[(2S)-1-[(4-aminophenyl)methyl]pyrrolidin-2-yl]ethanol
CID 129390025
1-[1-[(4-aminophenyl)methyl]pyrrolidin-2-yl]ethanol
CID 59300179
(1R)-1-[(2R)-1-[(4-nitrophenyl)methyl]piperidin-2-yl]ethanol
CID 95353429
4-[[2-(methylaminomethyl)piperidin-1-yl]methyl]benzamide
CID 63249745
3-[[2-(1-aminoethyl)piperidin-1-yl]methyl]benzamide;hydrochloride
CID 119911778
1-[1-(furan-3-ylmethyl)piperidin-2-yl]ethanol
CID 115882688
methyl 4-[[2-(1-hydroxypropyl)piperidin-1-yl]methyl]benzoate
CID 111332221
1-[1-(1H-pyrrol-3-ylmethyl)piperidin-2-yl]ethanol
CID 115882687
4-[[2-(1-aminoethyl)piperidin-1-yl]methyl]phenol
CID 63254190
4-[[(2R)-2-[(1R,2R)-2-hydroxycyclohexyl]pyrrolidin-1-yl]methyl]benzamide
CID 129480393
4-[[2-(2-hydroxypropyl)piperidin-1-yl]methyl]benzoic acid
CID 114337900

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide?
The IUPAC name of 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide (CID 111106900) is 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide.
What is the SMILES notation for 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide?
The canonical SMILES for 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide is CC(O)C1CCCCN1Cc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide?
The InChIKey is BMHXQPSUTZBAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(18)14-4-2-3-9-17(14)10-12-5-7-13(8-6-12)15(16)19/h5-8,11,14,18H,2-4,9-10H2,1H3,(H2,16,19).
What are the key properties of 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide?
4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide has a molecular weight of 262.35 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide is sourced from PubChem (CID 111106900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).