N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide

C10H18N2O3 — CID 70917012

IUPACN-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide
SMILESCC(=O)N1CCC(N(C)C(=O)CO)CC1
InChIInChI=1S/C10H18N2O3/c1-8(14)12-5-3-9(4-6-12)11(2)10(15)7-13/h9,13H,3-7H2,1-2H3
InChIKeyVUSJVJLVXIWKJC-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.55
Rot. Bonds2

About N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide

N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide (PubChem CID 70917012) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide
PubChem CID70917012
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide
SMILESCC(=O)N1CCC(N(C)C(=O)CO)CC1
InChIInChI=1S/C10H18N2O3/c1-8(14)12-5-3-9(4-6-12)11(2)10(15)7-13/h9,13H,3-7H2,1-2H3
InChIKeyVUSJVJLVXIWKJC-UHFFFAOYSA-N
XLogP-0.55
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide (CID 70917012) is N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide is CC(=O)N1CCC(N(C)C(=O)CO)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide?
The InChIKey is VUSJVJLVXIWKJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-8(14)12-5-3-9(4-6-12)11(2)10(15)7-13/h9,13H,3-7H2,1-2H3.
What are the key properties of N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide?
N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide has a molecular weight of 214.26 g/mol, XLogP of -0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 70917012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).