2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide

C13H13N3O2 — CID 23876862

IUPAC2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1cccnc1
InChIInChI=1S/C13H13N3O2/c1-2-18-13-11(6-4-8-15-13)12(17)16-10-5-3-7-14-9-10/h3-9H,2H2,1H3,(H,16,17)
InChIKeyCCDGYZPWJZUOLU-UHFFFAOYSA-N
MW243.27 g/mol
LogP2.13
Rot. Bonds4

About 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide

2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide (PubChem CID 23876862) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
PubChem CID23876862
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1cccnc1
InChIInChI=1S/C13H13N3O2/c1-2-18-13-11(6-4-8-15-13)12(17)16-10-5-3-7-14-9-10/h3-9H,2H2,1H3,(H,16,17)
InChIKeyCCDGYZPWJZUOLU-UHFFFAOYSA-N
XLogP2.13
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide
CID 7959021
2-ethoxy-N-[3-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 17392452
N-(2-anilinophenyl)-2-ethoxypyridine-3-carboxamide
CID 44760849
1-[(2-ethoxy-3-pyridinyl)methyl]-3-pyridin-3-ylurea
CID 47159517
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
2-ethoxy-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 2096181
5-[(4-ethoxybenzoyl)amino]-2-methyl-N-pyridin-3-ylbenzamide
CID 68847824
2-ethoxy-N-(2-phenylphenyl)pyridine-3-carboxamide
CID 2464326
2-ethoxy-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-carboxamide
CID 51076681
2-(propan-2-ylideneamino)-N-pyridin-3-ylbenzamide
CID 50851065
methyl 2-[(2-ethoxypyridine-3-carbonyl)amino]acetate
CID 27682250
N-[2-[(2R)-butan-2-yl]phenyl]-2-ethoxypyridine-3-carboxamide
CID 7936129

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide (CID 23876862) is 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide is CCOc1ncccc1C(=O)Nc1cccnc1.
What is the InChIKey of 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide?
The InChIKey is CCDGYZPWJZUOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-2-18-13-11(6-4-8-15-13)12(17)16-10-5-3-7-14-9-10/h3-9H,2H2,1H3,(H,16,17).
What are the key properties of 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide?
2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 23876862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).