N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide

C11H19N3O — CID 43213995

IUPACN-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide
SMILESCN(CCC#N)C(=O)CN1CCCCC1
InChIInChI=1S/C11H19N3O/c1-13(7-5-6-12)11(15)10-14-8-3-2-4-9-14/h2-5,7-10H2,1H3
InChIKeyGKXVEAZGCALBPO-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.84
Rot. Bonds4

About N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide

N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide (PubChem CID 43213995) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide
PubChem CID43213995
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide
SMILESCN(CCC#N)C(=O)CN1CCCCC1
InChIInChI=1S/C11H19N3O/c1-13(7-5-6-12)11(15)10-14-8-3-2-4-9-14/h2-5,7-10H2,1H3
InChIKeyGKXVEAZGCALBPO-UHFFFAOYSA-N
XLogP0.84
TPSA47.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide?
The IUPAC name of N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide (CID 43213995) is N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide is CN(CCC#N)C(=O)CN1CCCCC1.
What is the InChIKey of N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide?
The InChIKey is GKXVEAZGCALBPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-13(7-5-6-12)11(15)10-14-8-3-2-4-9-14/h2-5,7-10H2,1H3.
What are the key properties of N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide?
N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide has a molecular weight of 209.29 g/mol, XLogP of 0.84, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanoethyl)-N-methyl-2-piperidin-1-ylacetamide is sourced from PubChem (CID 43213995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).