N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide

C18H21N3O3 — CID 17454919

IUPACN-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C18H21N3O3/c1-2-24-16-6-4-15(5-7-16)20-18(22)14-3-8-17(19-13-14)21-9-11-23-12-10-21/h3-8,13H,2,9-12H2,1H3,(H,20,22)
InChIKeyUUHXWLNPPDMSBB-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.57
Rot. Bonds5

About N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide

N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 17454919) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
PubChem CID17454919
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC NameN-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C18H21N3O3/c1-2-24-16-6-4-15(5-7-16)20-18(22)14-3-8-17(19-13-14)21-9-11-23-12-10-21/h3-8,13H,2,9-12H2,1H3,(H,20,22)
InChIKeyUUHXWLNPPDMSBB-UHFFFAOYSA-N
XLogP2.57
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide (CID 17454919) is N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide is CCOc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is UUHXWLNPPDMSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-2-24-16-6-4-15(5-7-16)20-18(22)14-3-8-17(19-13-14)21-9-11-23-12-10-21/h3-8,13H,2,9-12H2,1H3,(H,20,22).
What are the key properties of N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide?
N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 17454919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).