5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile

C13H19N3O4 — CID 103469800

IUPAC5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile
SMILESCOCCOCCOCCOc1ncc(C#N)cc1N
InChIInChI=1S/C13H19N3O4/c1-17-2-3-18-4-5-19-6-7-20-13-12(15)8-11(9-14)10-16-13/h8,10H,2-7,15H2,1H3
InChIKeyMATMLPIBCCDDIA-UHFFFAOYSA-N
MW281.31 g/mol
LogP0.59
Rot. Bonds10

About 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile

5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile (PubChem CID 103469800) has the molecular formula C13H19N3O4 and a molecular weight of 281.31 g/mol. Its IUPAC name is 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile.

Molecular Properties

Compound Name5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile
PubChem CID103469800
Molecular FormulaC13H19N3O4
Molecular Weight281.31 g/mol
Exact Mass281.14
IUPAC Name5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile
SMILESCOCCOCCOCCOc1ncc(C#N)cc1N
InChIInChI=1S/C13H19N3O4/c1-17-2-3-18-4-5-19-6-7-20-13-12(15)8-11(9-14)10-16-13/h8,10H,2-7,15H2,1H3
InChIKeyMATMLPIBCCDDIA-UHFFFAOYSA-N
XLogP0.59
TPSA99.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile 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

5-amino-6-[2-(2-methoxyethoxy)ethylamino]pyridine-3-carbonitrile
CID 103468093
5-amino-6-[2-[di(propan-2-yl)amino]ethoxy]pyridine-3-carbonitrile
CID 103469781
5-bromo-2-[3-(2-methoxyethoxy)propoxy]pyridin-3-amine
CID 103400992
2-[2-(2-methoxyethoxy)ethoxy]-6-methylpyridine-4-carbonitrile
CID 114766986
5-amino-6-(4-propoxyphenoxy)pyridine-3-carbonitrile
CID 103469582
3-amino-5-iodo-4-[3-(2-methoxyethoxy)propoxy]benzonitrile
CID 103408891
4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzonitrile
CID 177395107
4-[2-(2-methoxyethoxy)ethoxy]benzonitrile
CID 43289507
3-amino-5-iodo-4-[2-(3-methoxypropoxy)ethoxy]benzonitrile
CID 103177319
5-amino-6-(furan-2-ylmethoxy)pyridine-3-carbonitrile
CID 103469423
5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile
CID 103468022
5-amino-6-(2-methoxy-4-methylphenoxy)pyridine-3-carbonitrile
CID 103469506

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile?
The IUPAC name of 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile (CID 103469800) is 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile.
What is the SMILES notation for 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile?
The canonical SMILES for 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile is COCCOCCOCCOc1ncc(C#N)cc1N.
What is the InChIKey of 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile?
The InChIKey is MATMLPIBCCDDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O4/c1-17-2-3-18-4-5-19-6-7-20-13-12(15)8-11(9-14)10-16-13/h8,10H,2-7,15H2,1H3.
What are the key properties of 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile?
5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile has a molecular weight of 281.31 g/mol, XLogP of 0.59, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile is sourced from PubChem (CID 103469800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).