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

C9H13N3O2 — CID 81235993

IUPAC4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide
SMILESCOCCNC(=O)c1cnccc1N
InChIInChI=1S/C9H13N3O2/c1-14-5-4-12-9(13)7-6-11-3-2-8(7)10/h2-3,6H,4-5H2,1H3,(H2,10,11)(H,12,13)
InChIKeyFQBZGUHULIMCGQ-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.04
Rot. Bonds4

About 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide

4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide (PubChem CID 81235993) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide
PubChem CID81235993
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide
SMILESCOCCNC(=O)c1cnccc1N
InChIInChI=1S/C9H13N3O2/c1-14-5-4-12-9(13)7-6-11-3-2-8(7)10/h2-3,6H,4-5H2,1H3,(H2,10,11)(H,12,13)
InChIKeyFQBZGUHULIMCGQ-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

1-(4-amino-3-pyridinyl)-4-methoxybutan-1-one
CID 65094552
4-amino-N-(2-hydroxypropyl)pyridine-3-carboxamide
CID 123975381
4-[2-(2-methoxyethoxy)ethylcarbamoyl]pyridine-3-carboxylic acid
CID 114244377
3-amino-N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]pyridine-4-carboxamide
CID 105071103
4-amino-N-(2,2-dimethylbutyl)pyridine-3-carboxamide
CID 103464710
4-(4-methoxybutylcarbamoyl)pyridine-3-carboxylic acid
CID 114244376
3-(3-hydroxyprop-1-ynyl)-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 66482239
2-[(3-amino-4-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
CID 43299918
methyl 4-amino-3-(2-methoxyethylcarbamoyl)benzoate
CID 89026105
4-amino-N-[2-(4-fluoro-2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 81245489
4-amino-N-[(2,4-dimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 81235643
1-N,2-N-bis(2-methoxyethyl)benzene-1,2-dicarboxamide
CID 4574574

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide (CID 81235993) is 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide is COCCNC(=O)c1cnccc1N.
What is the InChIKey of 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide?
The InChIKey is FQBZGUHULIMCGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-14-5-4-12-9(13)7-6-11-3-2-8(7)10/h2-3,6H,4-5H2,1H3,(H2,10,11)(H,12,13).
What are the key properties of 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide?
4-amino-N-(2-methoxyethyl)pyridine-3-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 4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81235993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).