N-(2H-pyridin-1-ylmethyl)acetamide

C8H12N2O — CID 20689828

IUPACN-(2H-pyridin-1-ylmethyl)acetamide
SMILESCC(=O)NCN1C=CC=CC1
InChIInChI=1S/C8H12N2O/c1-8(11)9-7-10-5-3-2-4-6-10/h2-5H,6-7H2,1H3,(H,9,11)
InChIKeyAZMFTYQLGKIMHU-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.47
Rot. Bonds2

About N-(2H-pyridin-1-ylmethyl)acetamide

N-(2H-pyridin-1-ylmethyl)acetamide (PubChem CID 20689828) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is N-(2H-pyridin-1-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(2H-pyridin-1-ylmethyl)acetamide
PubChem CID20689828
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC NameN-(2H-pyridin-1-ylmethyl)acetamide
SMILESCC(=O)NCN1C=CC=CC1
InChIInChI=1S/C8H12N2O/c1-8(11)9-7-10-5-3-2-4-6-10/h2-5H,6-7H2,1H3,(H,9,11)
InChIKeyAZMFTYQLGKIMHU-UHFFFAOYSA-N
XLogP0.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2H-pyridin-1-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2H-pyridin-1-ylmethyl)acetamide?
The IUPAC name of N-(2H-pyridin-1-ylmethyl)acetamide (CID 20689828) is N-(2H-pyridin-1-ylmethyl)acetamide.
What is the SMILES notation for N-(2H-pyridin-1-ylmethyl)acetamide?
The canonical SMILES for N-(2H-pyridin-1-ylmethyl)acetamide is CC(=O)NCN1C=CC=CC1.
What is the InChIKey of N-(2H-pyridin-1-ylmethyl)acetamide?
The InChIKey is AZMFTYQLGKIMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-8(11)9-7-10-5-3-2-4-6-10/h2-5H,6-7H2,1H3,(H,9,11).
What are the key properties of N-(2H-pyridin-1-ylmethyl)acetamide?
N-(2H-pyridin-1-ylmethyl)acetamide has a molecular weight of 152.20 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2H-pyridin-1-ylmethyl)acetamide is sourced from PubChem (CID 20689828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).