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

C17H20N2O2 — CID 86967702

IUPAC2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)NCCc2cccc(C)c2)ccn1
InChIInChI=1S/C17H20N2O2/c1-3-21-16-12-15(8-10-18-16)17(20)19-9-7-14-6-4-5-13(2)11-14/h4-6,8,10-12H,3,7,9H2,1-2H3,(H,19,20)
InChIKeyFFHYKMZDTKJCCV-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.76
Rot. Bonds6

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

2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide (PubChem CID 86967702) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide
PubChem CID86967702
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)NCCc2cccc(C)c2)ccn1
InChIInChI=1S/C17H20N2O2/c1-3-21-16-12-15(8-10-18-16)17(20)19-9-7-14-6-4-5-13(2)11-14/h4-6,8,10-12H,3,7,9H2,1-2H3,(H,19,20)
InChIKeyFFHYKMZDTKJCCV-UHFFFAOYSA-N
XLogP2.76
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
CID 84580463
2-N-[(3-methylphenyl)methyl]-4-N-(2-phenylethyl)pyridine-2,4-dicarboxamide
CID 109085771
3-hydroxy-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62313945
2-ethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]pyridine-4-carboxamide
CID 86968073
N-[2-(3-methylphenyl)ethyl]-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 51102624
3-(chloromethyl)-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62314649
3-amino-N-[2-(3-methylphenyl)ethyl]benzamide
CID 62313883
2-N-ethyl-2-N-(3-methylphenyl)-4-N-(2-phenylethyl)pyridine-2,4-dicarboxamide
CID 109087759
4-hydroxy-3-methyl-N-[2-(3-methylphenyl)ethyl]benzamide
CID 103951860
6-fluoro-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 63978992
6-amino-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62313054
2-ethoxy-N-[4-(N-methylanilino)butyl]pyridine-4-carboxamide
CID 86968104

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide (CID 86967702) is 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide is CCOc1cc(C(=O)NCCc2cccc(C)c2)ccn1.
What is the InChIKey of 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide?
The InChIKey is FFHYKMZDTKJCCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-21-16-12-15(8-10-18-16)17(20)19-9-7-14-6-4-5-13(2)11-14/h4-6,8,10-12H,3,7,9H2,1-2H3,(H,19,20).
What are the key properties of 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide?
2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(3-methylphenyl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 86967702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).