2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide

C13H24N2O — CID 118358852

IUPAC2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide
SMILESC=C(CN1CCCCC1)NC(=O)C(C)(C)C
InChIInChI=1S/C13H24N2O/c1-11(14-12(16)13(2,3)4)10-15-8-6-5-7-9-15/h1,5-10H2,2-4H3,(H,14,16)
InChIKeyYYQSWNBFVVIBCX-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.15
Rot. Bonds3

About 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide

2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide (PubChem CID 118358852) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide
PubChem CID118358852
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide
SMILESC=C(CN1CCCCC1)NC(=O)C(C)(C)C
InChIInChI=1S/C13H24N2O/c1-11(14-12(16)13(2,3)4)10-15-8-6-5-7-9-15/h1,5-10H2,2-4H3,(H,14,16)
InChIKeyYYQSWNBFVVIBCX-UHFFFAOYSA-N
XLogP2.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide (CID 118358852) is 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide is C=C(CN1CCCCC1)NC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide?
The InChIKey is YYQSWNBFVVIBCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-11(14-12(16)13(2,3)4)10-15-8-6-5-7-9-15/h1,5-10H2,2-4H3,(H,14,16).
What are the key properties of 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide?
2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide has a molecular weight of 224.35 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(3-piperidin-1-ylprop-1-en-2-yl)propanamide is sourced from PubChem (CID 118358852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).