N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide

C14H26N2O — CID 118282872

IUPACN-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide
SMILESC=C(NC(=O)C(C)(C)C)C1CCN(CC)CC1
InChIInChI=1S/C14H26N2O/c1-6-16-9-7-12(8-10-16)11(2)15-13(17)14(3,4)5/h12H,2,6-10H2,1,3-5H3,(H,15,17)
InChIKeyJICFHXGKOBLTRM-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.39
Rot. Bonds3

About N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide

N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide (PubChem CID 118282872) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide
PubChem CID118282872
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide
SMILESC=C(NC(=O)C(C)(C)C)C1CCN(CC)CC1
InChIInChI=1S/C14H26N2O/c1-6-16-9-7-12(8-10-16)11(2)15-13(17)14(3,4)5/h12H,2,6-10H2,1,3-5H3,(H,15,17)
InChIKeyJICFHXGKOBLTRM-UHFFFAOYSA-N
XLogP2.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide (CID 118282872) is N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide is C=C(NC(=O)C(C)(C)C)C1CCN(CC)CC1.
What is the InChIKey of N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide?
The InChIKey is JICFHXGKOBLTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-6-16-9-7-12(8-10-16)11(2)15-13(17)14(3,4)5/h12H,2,6-10H2,1,3-5H3,(H,15,17).
What are the key properties of N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide?
N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide has a molecular weight of 238.37 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylpiperidin-4-yl)ethenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 118282872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).