N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide

C13H13N3O3 — CID 63859607

IUPACN-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cncc(O)c1
InChIInChI=1S/C13H13N3O3/c1-2-19-13-11(4-3-5-15-13)16-12(18)9-6-10(17)8-14-7-9/h3-8,17H,2H2,1H3,(H,16,18)
InChIKeyVVVZEQDPDYXGFG-UHFFFAOYSA-N
MW259.26 g/mol
LogP1.83
Rot. Bonds4

About N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide

N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63859607) has the molecular formula C13H13N3O3 and a molecular weight of 259.26 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
PubChem CID63859607
Molecular FormulaC13H13N3O3
Molecular Weight259.26 g/mol
Exact Mass259.10
IUPAC NameN-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cncc(O)c1
InChIInChI=1S/C13H13N3O3/c1-2-19-13-11(4-3-5-15-13)16-12(18)9-6-10(17)8-14-7-9/h3-8,17H,2H2,1H3,(H,16,18)
InChIKeyVVVZEQDPDYXGFG-UHFFFAOYSA-N
XLogP1.83
TPSA84.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide (CID 63859607) is N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide is CCOc1ncccc1NC(=O)c1cncc(O)c1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is VVVZEQDPDYXGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3/c1-2-19-13-11(4-3-5-15-13)16-12(18)9-6-10(17)8-14-7-9/h3-8,17H,2H2,1H3,(H,16,18).
What are the key properties of N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide?
N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 259.26 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63859607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).