2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide

C18H21N3O3 — CID 67240094

IUPAC2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1
InChIInChI=1S/C18H21N3O3/c1-2-23-17-11-14(7-8-20-17)18(22)21-15-5-3-13(4-6-15)16-12-19-9-10-24-16/h3-8,11,16,19H,2,9-10,12H2,1H3,(H,21,22)
InChIKeyWBRDEYVGYUYWCT-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.39
Rot. Bonds5

About 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide

2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide (PubChem CID 67240094) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide
PubChem CID67240094
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC Name2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1
InChIInChI=1S/C18H21N3O3/c1-2-23-17-11-14(7-8-20-17)18(22)21-15-5-3-13(4-6-15)16-12-19-9-10-24-16/h3-8,11,16,19H,2,9-10,12H2,1H3,(H,21,22)
InChIKeyWBRDEYVGYUYWCT-UHFFFAOYSA-N
XLogP2.39
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide (CID 67240094) is 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide is CCOc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1.
What is the InChIKey of 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide?
The InChIKey is WBRDEYVGYUYWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-2-23-17-11-14(7-8-20-17)18(22)21-15-5-3-13(4-6-15)16-12-19-9-10-24-16/h3-8,11,16,19H,2,9-10,12H2,1H3,(H,21,22).
What are the key properties of 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide?
2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(4-morpholin-2-ylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 67240094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).