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

C9H16N2O — CID 135130696

IUPACN-(3-ethenylpiperidin-4-yl)acetamide
SMILESC=CC1CNCCC1NC(C)=O
InChIInChI=1S/C9H16N2O/c1-3-8-6-10-5-4-9(8)11-7(2)12/h3,8-10H,1,4-6H2,2H3,(H,11,12)
InChIKeyRJELRLDQSFSUJO-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.29
Rot. Bonds2

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

N-(3-ethenylpiperidin-4-yl)acetamide (PubChem CID 135130696) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N-(3-ethenylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-ethenylpiperidin-4-yl)acetamide
PubChem CID135130696
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN-(3-ethenylpiperidin-4-yl)acetamide
SMILESC=CC1CNCCC1NC(C)=O
InChIInChI=1S/C9H16N2O/c1-3-8-6-10-5-4-9(8)11-7(2)12/h3,8-10H,1,4-6H2,2H3,(H,11,12)
InChIKeyRJELRLDQSFSUJO-UHFFFAOYSA-N
XLogP0.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethenylpiperidin-4-yl)acetamide?
The IUPAC name of N-(3-ethenylpiperidin-4-yl)acetamide (CID 135130696) is N-(3-ethenylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(3-ethenylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(3-ethenylpiperidin-4-yl)acetamide is C=CC1CNCCC1NC(C)=O.
What is the InChIKey of N-(3-ethenylpiperidin-4-yl)acetamide?
The InChIKey is RJELRLDQSFSUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-3-8-6-10-5-4-9(8)11-7(2)12/h3,8-10H,1,4-6H2,2H3,(H,11,12).
What are the key properties of N-(3-ethenylpiperidin-4-yl)acetamide?
N-(3-ethenylpiperidin-4-yl)acetamide has a molecular weight of 168.24 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethenylpiperidin-4-yl)acetamide is sourced from PubChem (CID 135130696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).