2-piperidin-4-ylprop-2-enamide

C8H14N2O — CID 68571404

IUPAC2-piperidin-4-ylprop-2-enamide
SMILESC=C(C(N)=O)C1CCNCC1
InChIInChI=1S/C8H14N2O/c1-6(8(9)11)7-2-4-10-5-3-7/h7,10H,1-5H2,(H2,9,11)
InChIKeyVOQVPMHHDLTTNF-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.03
Rot. Bonds2

About 2-piperidin-4-ylprop-2-enamide

2-piperidin-4-ylprop-2-enamide (PubChem CID 68571404) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-piperidin-4-ylprop-2-enamide.

Molecular Properties

Compound Name2-piperidin-4-ylprop-2-enamide
PubChem CID68571404
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-piperidin-4-ylprop-2-enamide
SMILESC=C(C(N)=O)C1CCNCC1
InChIInChI=1S/C8H14N2O/c1-6(8(9)11)7-2-4-10-5-3-7/h7,10H,1-5H2,(H2,9,11)
InChIKeyVOQVPMHHDLTTNF-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-ylprop-2-enamide?
The IUPAC name of 2-piperidin-4-ylprop-2-enamide (CID 68571404) is 2-piperidin-4-ylprop-2-enamide.
What is the SMILES notation for 2-piperidin-4-ylprop-2-enamide?
The canonical SMILES for 2-piperidin-4-ylprop-2-enamide is C=C(C(N)=O)C1CCNCC1.
What is the InChIKey of 2-piperidin-4-ylprop-2-enamide?
The InChIKey is VOQVPMHHDLTTNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-6(8(9)11)7-2-4-10-5-3-7/h7,10H,1-5H2,(H2,9,11).
What are the key properties of 2-piperidin-4-ylprop-2-enamide?
2-piperidin-4-ylprop-2-enamide has a molecular weight of 154.21 g/mol, XLogP of 0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-ylprop-2-enamide is sourced from PubChem (CID 68571404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).