2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide

C13H21N3O2 — CID 107338236

IUPAC2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide
SMILESCCCCOCCNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C13H21N3O2/c1-2-3-7-18-8-6-15-13(17)9-12-5-4-11(14)10-16-12/h4-5,10H,2-3,6-9,14H2,1H3,(H,15,17)
InChIKeyHZEJAEZXUNNOKZ-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.14
Rot. Bonds8

About 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide

2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide (PubChem CID 107338236) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide
PubChem CID107338236
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide
SMILESCCCCOCCNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C13H21N3O2/c1-2-3-7-18-8-6-15-13(17)9-12-5-4-11(14)10-16-12/h4-5,10H,2-3,6-9,14H2,1H3,(H,15,17)
InChIKeyHZEJAEZXUNNOKZ-UHFFFAOYSA-N
XLogP1.14
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

Pyroxamide
CID 4996
2-Pyridineacetamide
CID 227129
1,3-Dihydro-2H-pyrrolo[3,2-b]pyridin-2-one
CID 316367
1-(2-Oxo-2-((2-((1-oxododecyl)oxy)ethyl)amino)ethyl)pyridinium
CID 22660
1-(2-methoxyethyl)-N-[(3-methyl-2-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 24819416
(2Z)-N-[2-(diethylamino)ethyl]-2-(hydroxyimino)-2-(pyridin-2-yl)ethanamide
CID 135455169
(2Z)-N-cyclohexyl-2-nitroso-2-(1H-pyridin-2-ylidene)acetamide
CID 135431429
3-{[[(2-methoxyethyl)amino](oxo)acetyl]hydrazono}-N-(3-pyridinyl)butanamide
CID 9592417
N-phenyl-2-(2-pyridinyl)acetamide
CID 651166
10-Undecenamide, N-(2-pyridylmethyl)-
CID 294296
2-Acetamidoethyl pyridin-3-ylcarbamate
CID 1965494
N-Phenyl-2-pyridin-2-yl-acetamide
CID 6603634

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide (CID 107338236) is 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide is CCCCOCCNC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide?
The InChIKey is HZEJAEZXUNNOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-2-3-7-18-8-6-15-13(17)9-12-5-4-11(14)10-16-12/h4-5,10H,2-3,6-9,14H2,1H3,(H,15,17).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide?
2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 1.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(2-butoxyethyl)acetamide is sourced from PubChem (CID 107338236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).