2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide

C17H20N2O3 — CID 9113215

IUPAC2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1ccc(OC)cc1
InChIInChI=1S/C17H20N2O3/c1-3-22-17-15(5-4-11-19-17)16(20)18-12-10-13-6-8-14(21-2)9-7-13/h4-9,11H,3,10,12H2,1-2H3,(H,18,20)
InChIKeyHJOKYTYIUGPWFH-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.46
Rot. Bonds7

About 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide

2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 9113215) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
PubChem CID9113215
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1ccc(OC)cc1
InChIInChI=1S/C17H20N2O3/c1-3-22-17-15(5-4-11-19-17)16(20)18-12-10-13-6-8-14(21-2)9-7-13/h4-9,11H,3,10,12H2,1-2H3,(H,18,20)
InChIKeyHJOKYTYIUGPWFH-UHFFFAOYSA-N
XLogP2.46
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide (CID 9113215) is 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide is CCOc1ncccc1C(=O)NCCc1ccc(OC)cc1.
What is the InChIKey of 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is HJOKYTYIUGPWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-3-22-17-15(5-4-11-19-17)16(20)18-12-10-13-6-8-14(21-2)9-7-13/h4-9,11H,3,10,12H2,1-2H3,(H,18,20).
What are the key properties of 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 9113215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).