N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide

C11H18N2O2 — CID 135130697

IUPACN-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide
SMILESC=CC1CN(C(C)=O)CCC1NC(C)=O
InChIInChI=1S/C11H18N2O2/c1-4-10-7-13(9(3)15)6-5-11(10)12-8(2)14/h4,10-11H,1,5-7H2,2-3H3,(H,12,14)
InChIKeyDYDCFTNZOIDVOD-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.55
Rot. Bonds2

About N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide

N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide (PubChem CID 135130697) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide
PubChem CID135130697
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide
SMILESC=CC1CN(C(C)=O)CCC1NC(C)=O
InChIInChI=1S/C11H18N2O2/c1-4-10-7-13(9(3)15)6-5-11(10)12-8(2)14/h4,10-11H,1,5-7H2,2-3H3,(H,12,14)
InChIKeyDYDCFTNZOIDVOD-UHFFFAOYSA-N
XLogP0.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-(1-acetyl-3-ethenylpiperidin-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 N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide?
The IUPAC name of N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide (CID 135130697) is N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide is C=CC1CN(C(C)=O)CCC1NC(C)=O.
What is the InChIKey of N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide?
The InChIKey is DYDCFTNZOIDVOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-10-7-13(9(3)15)6-5-11(10)12-8(2)14/h4,10-11H,1,5-7H2,2-3H3,(H,12,14).
What are the key properties of N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide?
N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-3-ethenylpiperidin-4-yl)acetamide is sourced from PubChem (CID 135130697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).