N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide

C13H19N3O — CID 43602089

IUPACN-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide
SMILESCN(C(=O)Cc1ccncc1)C1CCNCC1
InChIInChI=1S/C13H19N3O/c1-16(12-4-8-15-9-5-12)13(17)10-11-2-6-14-7-3-11/h2-3,6-7,12,15H,4-5,8-10H2,1H3
InChIKeyBFNROJFFYWDRDP-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.83
Rot. Bonds3

About N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide

N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide (PubChem CID 43602089) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide
PubChem CID43602089
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide
SMILESCN(C(=O)Cc1ccncc1)C1CCNCC1
InChIInChI=1S/C13H19N3O/c1-16(12-4-8-15-9-5-12)13(17)10-11-2-6-14-7-3-11/h2-3,6-7,12,15H,4-5,8-10H2,1H3
InChIKeyBFNROJFFYWDRDP-UHFFFAOYSA-N
XLogP0.83
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide?
The IUPAC name of N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide (CID 43602089) is N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide?
The canonical SMILES for N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide is CN(C(=O)Cc1ccncc1)C1CCNCC1.
What is the InChIKey of N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide?
The InChIKey is BFNROJFFYWDRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-16(12-4-8-15-9-5-12)13(17)10-11-2-6-14-7-3-11/h2-3,6-7,12,15H,4-5,8-10H2,1H3.
What are the key properties of N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide?
N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide has a molecular weight of 233.31 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-yl-2-pyridin-4-ylacetamide is sourced from PubChem (CID 43602089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).