3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide

C12H20N4O3 — CID 82034177

IUPAC3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide
SMILESNCCC(=O)Nc1ccc(NCCOCCO)cn1
InChIInChI=1S/C12H20N4O3/c13-4-3-12(18)16-11-2-1-10(9-15-11)14-5-7-19-8-6-17/h1-2,9,14,17H,3-8,13H2,(H,15,16,18)
InChIKeyCFCJYEOLISGAJH-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.21
Rot. Bonds9

About 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide

3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide (PubChem CID 82034177) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide
PubChem CID82034177
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide
SMILESNCCC(=O)Nc1ccc(NCCOCCO)cn1
InChIInChI=1S/C12H20N4O3/c13-4-3-12(18)16-11-2-1-10(9-15-11)14-5-7-19-8-6-17/h1-2,9,14,17H,3-8,13H2,(H,15,16,18)
InChIKeyCFCJYEOLISGAJH-UHFFFAOYSA-N
XLogP-0.21
TPSA109.50 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide 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

N-[6-[2-(2-hydroxyethoxy)ethylamino]-3-pyridinyl]-2,6-dimethoxybenzamide
CID 28901488
4-amino-N-[5-[2-(4-methoxyphenoxy)ethylamino]-2-pyridinyl]butanamide
CID 82034205
N-[6-[2-(2-hydroxyethoxy)ethylamino]-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 28901499
3-amino-N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]propanamide
CID 82034183
2-amino-N-[5-(5-hydroxypentylamino)-2-pyridinyl]acetamide
CID 39178424
N-[5-(3-aminopropanoylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 119879406
N-[6-[2-(2-hydroxyethoxy)ethylamino]-3-pyridinyl]-2-(1H-indol-3-yl)acetamide
CID 28901497
2-(3-ethylphenoxy)-N-[6-[2-(2-hydroxyethoxy)ethylamino]-3-pyridinyl]acetamide
CID 28901568
3-phenyl-N-[5-(2-phenylethylamino)-2-pyridinyl]propanamide
CID 113028011
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]-3-phenoxypropanamide
CID 113025743
3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 61274475
N-[5-(butylamino)-2-pyridinyl]-3-phenoxypropanamide
CID 113023996

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide?
The IUPAC name of 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide (CID 82034177) is 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide.
What is the SMILES notation for 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide?
The canonical SMILES for 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide is NCCC(=O)Nc1ccc(NCCOCCO)cn1.
What is the InChIKey of 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide?
The InChIKey is CFCJYEOLISGAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c13-4-3-12(18)16-11-2-1-10(9-15-11)14-5-7-19-8-6-17/h1-2,9,14,17H,3-8,13H2,(H,15,16,18).
What are the key properties of 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide?
3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide has a molecular weight of 268.32 g/mol, XLogP of -0.21, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[5-[2-(2-hydroxyethoxy)ethylamino]-2-pyridinyl]propanamide is sourced from PubChem (CID 82034177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).