7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide

C17H13ClN2O4 — CID 58525546

IUPAC7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide
SMILESCOc1cc2cc(C(=O)NO)cnc2cc1Oc1ccc(Cl)cc1
InChIInChI=1S/C17H13ClN2O4/c1-23-15-7-10-6-11(17(21)20-22)9-19-14(10)8-16(15)24-13-4-2-12(18)3-5-13/h2-9,22H,1H3,(H,20,21)
InChIKeyLAXMTUFZTHPGLB-UHFFFAOYSA-N
MW344.75 g/mol
LogP3.81
Rot. Bonds4

About 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide

7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide (PubChem CID 58525546) has the molecular formula C17H13ClN2O4 and a molecular weight of 344.75 g/mol. Its IUPAC name is 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide.

Molecular Properties

Compound Name7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide
PubChem CID58525546
Molecular FormulaC17H13ClN2O4
Molecular Weight344.75 g/mol
Exact Mass344.06
IUPAC Name7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide
SMILESCOc1cc2cc(C(=O)NO)cnc2cc1Oc1ccc(Cl)cc1
InChIInChI=1S/C17H13ClN2O4/c1-23-15-7-10-6-11(17(21)20-22)9-19-14(10)8-16(15)24-13-4-2-12(18)3-5-13/h2-9,22H,1H3,(H,20,21)
InChIKeyLAXMTUFZTHPGLB-UHFFFAOYSA-N
XLogP3.81
TPSA80.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.75
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(3,4-dimethoxyphenyl) 6,7-dimethoxyquinoline-3-carboxylate
CID 154447229
3,5-dichloro-N-[4-(6,7-dimethoxy-2-methylquinolin-3-yl)oxyphenyl]benzamide
CID 155812930
N-hydroxy-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]pyridine-6-carboxamide
CID 87266024
N-(3,4-difluorophenyl)-6-(6,7-dimethoxyquinolin-4-yl)oxyquinoline-3-carboxamide
CID 59813469
6-chloro-N-[5-chloro-2-(4-methoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 26267192
6-(6,7-dimethoxyquinolin-4-yl)oxyquinoline-3-carboxylic acid
CID 59813662
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-6-methoxypyridine-3-carboxamide
CID 134056596
methyl 2-[(7-chloroquinoline-3-carbonyl)amino]acetate
CID 110490073
3-(3-fluoro-4-methoxyphenyl)-N-hydroxyquinoxaline-6-carboxamide
CID 162733624
(6,7-dimethoxyquinolin-3-yl)oxyboronic acid
CID 156654423
methyl 2-[(7-methoxyquinoline-3-carbonyl)amino]acetate
CID 110489898
N-(2-hydroxyethyl)-6-methoxyquinoline-3-carboxamide
CID 110489941

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide?
The IUPAC name of 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide (CID 58525546) is 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide.
What is the SMILES notation for 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide?
The canonical SMILES for 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide is COc1cc2cc(C(=O)NO)cnc2cc1Oc1ccc(Cl)cc1.
What is the InChIKey of 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide?
The InChIKey is LAXMTUFZTHPGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O4/c1-23-15-7-10-6-11(17(21)20-22)9-19-14(10)8-16(15)24-13-4-2-12(18)3-5-13/h2-9,22H,1H3,(H,20,21).
What are the key properties of 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide?
7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide has a molecular weight of 344.75 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chlorophenoxy)-N-hydroxy-6-methoxyquinoline-3-carboxamide is sourced from PubChem (CID 58525546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).