2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide

C11H17N3O2 — CID 79799713

IUPAC2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide
SMILESCNC(=O)COc1ccc(CC(C)N)nc1
InChIInChI=1S/C11H17N3O2/c1-8(12)5-9-3-4-10(6-14-9)16-7-11(15)13-2/h3-4,6,8H,5,7,12H2,1-2H3,(H,13,15)
InChIKeyWFJKKVFFJLCGPV-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.10
Rot. Bonds5

About 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide

2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide (PubChem CID 79799713) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide.

Molecular Properties

Compound Name2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide
PubChem CID79799713
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide
SMILESCNC(=O)COc1ccc(CC(C)N)nc1
InChIInChI=1S/C11H17N3O2/c1-8(12)5-9-3-4-10(6-14-9)16-7-11(15)13-2/h3-4,6,8H,5,7,12H2,1-2H3,(H,13,15)
InChIKeyWFJKKVFFJLCGPV-UHFFFAOYSA-N
XLogP0.10
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide 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

2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]acetamide
CID 79800080
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]propanamide
CID 79796082
2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide
CID 115371615
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N-(1-methoxypropan-2-yl)acetamide
CID 79790819
1-[5-(2-fluoroethoxy)-2-pyridinyl]propan-2-amine
CID 80694475
1-(5-prop-2-enoxy-2-pyridinyl)propan-2-amine
CID 79795581
1-(5-pentoxy-2-pyridinyl)propan-2-amine
CID 79799904
1-[5-(3-chloroprop-2-enoxy)-2-pyridinyl]propan-2-amine
CID 79799523
1-(5-prop-2-ynoxy-2-pyridinyl)propan-2-amine
CID 79799433
2-[[6-(aminomethyl)-3-pyridinyl]oxy]-N-pentan-2-ylacetamide
CID 79775490
1-[5-[2-(4-bromophenoxy)ethoxy]-2-pyridinyl]propan-2-amine
CID 79790646
1-(5-hexoxy-2-pyridinyl)propan-2-amine
CID 79800440

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide?
The IUPAC name of 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide (CID 79799713) is 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide.
What is the SMILES notation for 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide?
The canonical SMILES for 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide is CNC(=O)COc1ccc(CC(C)N)nc1.
What is the InChIKey of 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide?
The InChIKey is WFJKKVFFJLCGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8(12)5-9-3-4-10(6-14-9)16-7-11(15)13-2/h3-4,6,8H,5,7,12H2,1-2H3,(H,13,15).
What are the key properties of 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide?
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide has a molecular weight of 223.28 g/mol, XLogP of 0.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide is sourced from PubChem (CID 79799713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).