3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide

C18H16N2O2 — CID 5302933

IUPAC3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide
SMILESCCOc1cc2ccccc2cc1C(=O)Nc1ccccn1
InChIInChI=1S/C18H16N2O2/c1-2-22-16-12-14-8-4-3-7-13(14)11-15(16)18(21)20-17-9-5-6-10-19-17/h3-12H,2H2,1H3,(H,19,20,21)
InChIKeyTYPDXWDBOSYOBY-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.89
Rot. Bonds4

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

3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide (PubChem CID 5302933) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide.

Molecular Properties

Compound Name3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide
PubChem CID5302933
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide
SMILESCCOc1cc2ccccc2cc1C(=O)Nc1ccccn1
InChIInChI=1S/C18H16N2O2/c1-2-22-16-12-14-8-4-3-7-13(14)11-15(16)18(21)20-17-9-5-6-10-19-17/h3-12H,2H2,1H3,(H,19,20,21)
InChIKeyTYPDXWDBOSYOBY-UHFFFAOYSA-N
XLogP3.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide?
The IUPAC name of 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide (CID 5302933) is 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide.
What is the SMILES notation for 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide?
The canonical SMILES for 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide is CCOc1cc2ccccc2cc1C(=O)Nc1ccccn1.
What is the InChIKey of 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide?
The InChIKey is TYPDXWDBOSYOBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-2-22-16-12-14-8-4-3-7-13(14)11-15(16)18(21)20-17-9-5-6-10-19-17/h3-12H,2H2,1H3,(H,19,20,21).
What are the key properties of 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide?
3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-pyridin-2-ylnaphthalene-2-carboxamide is sourced from PubChem (CID 5302933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).