N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide

C20H24N4O4 — CID 3454451

IUPACN-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
SMILESCCOc1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1O
InChIInChI=1S/C20H24N4O4/c1-2-28-18-4-3-15(13-17(18)25)14-22-23-20(26)19(16-5-7-21-8-6-16)24-9-11-27-12-10-24/h3-8,13-14,19,25H,2,9-12H2,1H3,(H,23,26)
InChIKeyGJGPSOTUXVRRIL-UHFFFAOYSA-N
MW384.44 g/mol
LogP1.71
Rot. Bonds7

About N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide

N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide (PubChem CID 3454451) has the molecular formula C20H24N4O4 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
PubChem CID3454451
Molecular FormulaC20H24N4O4
Molecular Weight384.44 g/mol
Exact Mass384.18
IUPAC NameN-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
SMILESCCOc1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1O
InChIInChI=1S/C20H24N4O4/c1-2-28-18-4-3-15(13-17(18)25)14-22-23-20(26)19(16-5-7-21-8-6-16)24-9-11-27-12-10-24/h3-8,13-14,19,25H,2,9-12H2,1H3,(H,23,26)
InChIKeyGJGPSOTUXVRRIL-UHFFFAOYSA-N
XLogP1.71
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
CID 3798221
N-[(Z)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]pyridine-4-carboxamide
CID 135538343
N-[(E)-(4-ethoxy-3-iodophenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 126007524
N-[(Z)-(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-(1,2,4-triazol-1-yl)acetamide
CID 5424576
N-[[3-ethoxy-4-(2-morpholin-4-ylethoxy)phenyl]methylideneamino]pyridine-3-carboxamide
CID 3254715
5-bromo-N-[(E)-(4-ethoxy-3-hydroxyphenyl)methylideneamino]furan-2-carboxamide
CID 6894268
2-(3,5-dimethylpyrazol-1-yl)-N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]acetamide
CID 3418713
N-[(Z)-[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylideneamino]-2-morpholin-4-ylacetamide
CID 126018159
3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 41082821
N-[[4-(cyanomethoxy)-3-ethoxyphenyl]methylideneamino]-2-morpholin-4-ylacetamide
CID 3696139
3,4-dichloro-N-[1-[(2Z)-2-[[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]hydrazinyl]-3-methyl-1-oxobutan-2-yl]benzamide
CID 6037597
(2S)-2-(4-ethoxyphenyl)-2-morpholin-4-ylacetic acid
CID 27378601

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The IUPAC name of N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide (CID 3454451) is N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide is CCOc1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1O.
What is the InChIKey of N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The InChIKey is GJGPSOTUXVRRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O4/c1-2-28-18-4-3-15(13-17(18)25)14-22-23-20(26)19(16-5-7-21-8-6-16)24-9-11-27-12-10-24/h3-8,13-14,19,25H,2,9-12H2,1H3,(H,23,26).
What are the key properties of N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide has a molecular weight of 384.44 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide is sourced from PubChem (CID 3454451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).