N-piperidin-1-ylprop-2-enamide

C8H14N2O — CID 23034650

IUPACN-piperidin-1-ylprop-2-enamide
SMILESC=CC(=O)NN1CCCCC1
InChIInChI=1S/C8H14N2O/c1-2-8(11)9-10-6-4-3-5-7-10/h2H,1,3-7H2,(H,9,11)
InChIKeyJCCGSOVTBIJRGP-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.69
Rot. Bonds2

About N-piperidin-1-ylprop-2-enamide

N-piperidin-1-ylprop-2-enamide (PubChem CID 23034650) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-piperidin-1-ylprop-2-enamide.

Molecular Properties

Compound NameN-piperidin-1-ylprop-2-enamide
PubChem CID23034650
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-piperidin-1-ylprop-2-enamide
SMILESC=CC(=O)NN1CCCCC1
InChIInChI=1S/C8H14N2O/c1-2-8(11)9-10-6-4-3-5-7-10/h2H,1,3-7H2,(H,9,11)
InChIKeyJCCGSOVTBIJRGP-UHFFFAOYSA-N
XLogP0.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloropiperidin-1-yl)prop-2-enamide
CID 23039336
(Z)-4-oxo-N-piperidin-1-ylbut-2-enamide
CID 58346827
1,2-Dihydropyridazine-3,6-dione;1,1-dimethylpiperidin-1-ium
CID 67360795
4-Piperidin-1-ylbut-2-enehydrazide
CID 69088465
2-pentyl-1H-pyridazine-3,6-dione
CID 70599423
4-oxo-N-piperidin-1-ylbut-2-enamide
CID 76768793
N'-pentyl-N-propylprop-2-enehydrazide
CID 87504088
N-butyl-N'-pentylprop-2-enehydrazide
CID 87505162
N-(2-oxopiperidin-1-yl)prop-2-enamide
CID 130991351
N',N'-dibutylprop-2-enehydrazide
CID 150447557
N',N'-dihexylprop-2-enehydrazide
CID 151750008
N-piperidin-1-ylbut-2-enamide
CID 153739102

Frequently Asked Questions

What is the IUPAC name of N-piperidin-1-ylprop-2-enamide?
The IUPAC name of N-piperidin-1-ylprop-2-enamide (CID 23034650) is N-piperidin-1-ylprop-2-enamide.
What is the SMILES notation for N-piperidin-1-ylprop-2-enamide?
The canonical SMILES for N-piperidin-1-ylprop-2-enamide is C=CC(=O)NN1CCCCC1.
What is the InChIKey of N-piperidin-1-ylprop-2-enamide?
The InChIKey is JCCGSOVTBIJRGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-8(11)9-10-6-4-3-5-7-10/h2H,1,3-7H2,(H,9,11).
What are the key properties of N-piperidin-1-ylprop-2-enamide?
N-piperidin-1-ylprop-2-enamide has a molecular weight of 154.21 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-1-ylprop-2-enamide is sourced from PubChem (CID 23034650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).