2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide

C13H24N2O3 — CID 63099068

IUPAC2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide
SMILESO=C(CN1CCC(CO)CC1)NC1CCOCC1
InChIInChI=1S/C13H24N2O3/c16-10-11-1-5-15(6-2-11)9-13(17)14-12-3-7-18-8-4-12/h11-12,16H,1-10H2,(H,14,17)
InChIKeyRJQFVMSKBPKEFD-UHFFFAOYSA-N
MW256.35 g/mol
LogP-0.01
Rot. Bonds4

About 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide

2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide (PubChem CID 63099068) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide
PubChem CID63099068
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide
SMILESO=C(CN1CCC(CO)CC1)NC1CCOCC1
InChIInChI=1S/C13H24N2O3/c16-10-11-1-5-15(6-2-11)9-13(17)14-12-3-7-18-8-4-12/h11-12,16H,1-10H2,(H,14,17)
InChIKeyRJQFVMSKBPKEFD-UHFFFAOYSA-N
XLogP-0.01
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide (CID 63099068) is 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide is O=C(CN1CCC(CO)CC1)NC1CCOCC1.
What is the InChIKey of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide?
The InChIKey is RJQFVMSKBPKEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c16-10-11-1-5-15(6-2-11)9-13(17)14-12-3-7-18-8-4-12/h11-12,16H,1-10H2,(H,14,17).
What are the key properties of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide?
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide has a molecular weight of 256.35 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 63099068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).