2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide

C12H20N4O2 — CID 106241754

IUPAC2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide
SMILESCCCNc1cccc(NCCOCC(N)=O)n1
InChIInChI=1S/C12H20N4O2/c1-2-6-14-11-4-3-5-12(16-11)15-7-8-18-9-10(13)17/h3-5H,2,6-9H2,1H3,(H2,13,17)(H2,14,15,16)
InChIKeyHWOMQDUXXZUPEJ-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.82
Rot. Bonds9

About 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide

2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide (PubChem CID 106241754) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide
PubChem CID106241754
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide
SMILESCCCNc1cccc(NCCOCC(N)=O)n1
InChIInChI=1S/C12H20N4O2/c1-2-6-14-11-4-3-5-12(16-11)15-7-8-18-9-10(13)17/h3-5H,2,6-9H2,1H3,(H2,13,17)(H2,14,15,16)
InChIKeyHWOMQDUXXZUPEJ-UHFFFAOYSA-N
XLogP0.82
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]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

2-[[6-(propylamino)-2-pyridinyl]amino]ethyl carbamate
CID 83214804
2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241892
2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide
CID 106234525
2-[2-[(5,6-diamino-2-pyridinyl)amino]ethoxy]acetamide
CID 106234451
2-[2-[(5-amino-6-methoxy-2-pyridinyl)amino]ethoxy]acetamide
CID 106234342
2-[2-[(5-bromo-6-methyl-2-pyridinyl)amino]ethoxy]acetamide
CID 106239798
2-[(2-amino-2-oxoethyl)-[[6-(propylamino)-2-pyridinyl]methyl]amino]acetamide
CID 79230668
methyl 2-[[6-(propylamino)-2-pyridinyl]amino]propanoate
CID 80801764
methyl 2-[[6-(propylamino)-2-pyridinyl]amino]acetate
CID 80778103
2-[2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241808
2-[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106242008
2-[2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]ethoxy]acetamide
CID 136805706

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide (CID 106241754) is 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide is CCCNc1cccc(NCCOCC(N)=O)n1.
What is the InChIKey of 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide?
The InChIKey is HWOMQDUXXZUPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-2-6-14-11-4-3-5-12(16-11)15-7-8-18-9-10(13)17/h3-5H,2,6-9H2,1H3,(H2,13,17)(H2,14,15,16).
What are the key properties of 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide?
2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide has a molecular weight of 252.32 g/mol, XLogP of 0.82, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide is sourced from PubChem (CID 106241754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).