3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide

C9H13N3O2 — CID 104740778

IUPAC3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCNC(=O)c1ncccc1N
InChIInChI=1S/C9H13N3O2/c1-14-6-5-12-9(13)8-7(10)3-2-4-11-8/h2-4H,5-6,10H2,1H3,(H,12,13)
InChIKeyXOQRUTHXDDHJNE-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.04
Rot. Bonds4

About 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide

3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide (PubChem CID 104740778) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
PubChem CID104740778
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCNC(=O)c1ncccc1N
InChIInChI=1S/C9H13N3O2/c1-14-6-5-12-9(13)8-7(10)3-2-4-11-8/h2-4H,5-6,10H2,1H3,(H,12,13)
InChIKeyXOQRUTHXDDHJNE-UHFFFAOYSA-N
XLogP0.04
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 104740997
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127
3-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 110474737
3-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 104741450
3-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 104740841
3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
CID 104740794
3-amino-N-[2-(methanesulfonamido)ethyl]pyridine-2-carboxamide
CID 104741062
ethyl 4-[(3-aminopyridine-2-carbonyl)amino]butanoate
CID 104742417
3-amino-N-(2-sulfamoylethyl)pyridine-2-carboxamide
CID 104741064
2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
CID 43300619
3-amino-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylpyridine-2-carboxamide
CID 104741760
3-amino-N-methoxypyridine-2-carboxamide;O-methylhydroxylamine;hydrochloride
CID 158937226

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide (CID 104740778) is 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide is COCCNC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide?
The InChIKey is XOQRUTHXDDHJNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-14-6-5-12-9(13)8-7(10)3-2-4-11-8/h2-4H,5-6,10H2,1H3,(H,12,13).
What are the key properties of 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide?
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 0.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 104740778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).