8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide

C20H19N3O3 — CID 53302491

IUPAC8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C20H19N3O3/c24-19-17(8-3-14-2-1-9-21-18(14)19)20(25)22-15-4-6-16(7-5-15)23-10-12-26-13-11-23/h1-9,24H,10-13H2,(H,22,25)
InChIKeyZIMAFLBTCNLNFZ-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.03
Rot. Bonds3

About 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide

8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide (PubChem CID 53302491) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide.

Molecular Properties

Compound Name8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide
PubChem CID53302491
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C20H19N3O3/c24-19-17(8-3-14-2-1-9-21-18(14)19)20(25)22-15-4-6-16(7-5-15)23-10-12-26-13-11-23/h1-9,24H,10-13H2,(H,22,25)
InChIKeyZIMAFLBTCNLNFZ-UHFFFAOYSA-N
XLogP3.03
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide;8-hydroxy-N-(oxan-4-yl)quinoline-7-carboxamide;8-hydroxy-N-[4-(1,2,4-triazol-1-yl)phenyl]quinoline-7-carboxamide
CID 159007155
2-amino-N-(4-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 82545859
8-hydroxy-N-[(4-morpholin-4-ylphenyl)methyl]quinoline-7-carboxamide;quinoline-7-carboxamide
CID 174777313
N-(9,10-dihydroanthracen-2-yl)-8-hydroxyquinoline-7-carboxamide
CID 20700238
2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
CID 781635
2-bromo-N-(4-morpholin-4-ylphenyl)benzamide
CID 1181771
N-(9H-fluoren-2-yl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
CID 18372482
2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-(4-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 9463227
8-hydroxy-N-[4-(4-nitrophenoxy)phenyl]quinoline-7-carboxamide;hydrochloride
CID 18372593
N-(4-morpholin-4-ylphenyl)-2-(4-quinolin-8-yloxyanilino)propanamide
CID 60601558
2-(2,5-dimethylphenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24628498
3-hydroxy-4-methoxy-N-(4-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 21088857

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide?
The IUPAC name of 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide (CID 53302491) is 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide.
What is the SMILES notation for 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide?
The canonical SMILES for 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide is O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc2cccnc2c1O.
What is the InChIKey of 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide?
The InChIKey is ZIMAFLBTCNLNFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c24-19-17(8-3-14-2-1-9-21-18(14)19)20(25)22-15-4-6-16(7-5-15)23-10-12-26-13-11-23/h1-9,24H,10-13H2,(H,22,25).
What are the key properties of 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide?
8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide is sourced from PubChem (CID 53302491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).