6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide

C113H85Cl3N20O18 — CID 159159196

IUPAC6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide
SMILESO=C(NO)c1cnc2cc(-c3ccncc3)ccc2c1.O=C(NO)c1cnc2cc(Nc3ccncc3)ccc2c1.O=C(NO)c1cnc2ccc(-c3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Cc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccncc3)cc2c1
InChIInChI=1S/C19H16N4O4.C17H13ClN2O2.C16H11ClN2O3.C16H11ClN2O2.C15H12N4O2.C15H11N3O3.C15H11N3O2/c24-18(11-1-2-11)22-17-9-15(5-6-20-17)27-14-3-4-16-12(8-14)7-13(10-21-16)19(25)23-26;18-15-4-1-11(2-5-15)7-12-3-6-16-13(8-12)9-14(10-19-16)17(21)20-22;17-12-1-3-13(4-2-12)22-14-5-6-15-10(8-14)7-11(9-18-15)16(20)19-21;17-14-4-1-10(2-5-14)11-3-6-15-12(7-11)8-13(9-18-15)16(20)19-21;20-15(19-21)11-7-10-1-2-13(8-14(10)17-9-11)18-12-3-5-16-6-4-12;19-15(18-20)11-7-10-8-13(1-2-14(10)17-9-11)21-12-3-5-16-6-4-12;19-15(18-20)13-7-12-2-1-11(8-14(12)17-9-13)10-3-5-16-6-4-10/h3-11,26H,1-2H2,(H,23,25)(H,20,22,24);1-6,8-10,22H,7H2,(H,20,21);1-9,21H,(H,19,20);1-9,21H,(H,19,20);1-9,21H,(H,16,18)(H,19,20);1-9,20H,(H,18,19);1-9,20H,(H,18,19)
InChIKeyKKGYTVQWNDJUER-UHFFFAOYSA-N
MW2117.40 g/mol
LogP21.41
Rot. Bonds21

About 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide

6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide (PubChem CID 159159196) has the molecular formula C113H85Cl3N20O18 and a molecular weight of 2117.40 g/mol. Its IUPAC name is 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide.

Molecular Properties

Compound Name6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide
PubChem CID159159196
Molecular FormulaC113H85Cl3N20O18
Molecular Weight2117.40 g/mol
Exact Mass2114.54
IUPAC Name6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide
SMILESO=C(NO)c1cnc2cc(-c3ccncc3)ccc2c1.O=C(NO)c1cnc2cc(Nc3ccncc3)ccc2c1.O=C(NO)c1cnc2ccc(-c3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Cc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccncc3)cc2c1
InChIInChI=1S/C19H16N4O4.C17H13ClN2O2.C16H11ClN2O3.C16H11ClN2O2.C15H12N4O2.C15H11N3O3.C15H11N3O2/c24-18(11-1-2-11)22-17-9-15(5-6-20-17)27-14-3-4-16-12(8-14)7-13(10-21-16)19(25)23-26;18-15-4-1-11(2-5-15)7-12-3-6-16-13(8-12)9-14(10-19-16)17(21)20-22;17-12-1-3-13(4-2-12)22-14-5-6-15-10(8-14)7-11(9-18-15)16(20)19-21;17-14-4-1-10(2-5-14)11-3-6-15-12(7-11)8-13(9-18-15)16(20)19-21;20-15(19-21)11-7-10-1-2-13(8-14(10)17-9-11)18-12-3-5-16-6-4-12;19-15(18-20)11-7-10-8-13(1-2-14(10)17-9-11)21-12-3-5-16-6-4-12;19-15(18-20)13-7-12-2-1-11(8-14(12)17-9-13)10-3-5-16-6-4-10/h3-11,26H,1-2H2,(H,23,25)(H,20,22,24);1-6,8-10,22H,7H2,(H,20,21);1-9,21H,(H,19,20);1-9,21H,(H,19,20);1-9,21H,(H,16,18)(H,19,20);1-9,20H,(H,18,19);1-9,20H,(H,18,19)
InChIKeyKKGYTVQWNDJUER-UHFFFAOYSA-N
XLogP21.41
TPSA555.92 Ų
H-Bond Donors16
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms154
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002117.40
LogP ≤ 521.41
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide?
The IUPAC name of 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide (CID 159159196) is 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide.
What is the SMILES notation for 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide?
The canonical SMILES for 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide is O=C(NO)c1cnc2cc(-c3ccncc3)ccc2c1.O=C(NO)c1cnc2cc(Nc3ccncc3)ccc2c1.O=C(NO)c1cnc2ccc(-c3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Cc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccc(Cl)cc3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)cc2c1.O=C(NO)c1cnc2ccc(Oc3ccncc3)cc2c1.
What is the InChIKey of 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide?
The InChIKey is KKGYTVQWNDJUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O4.C17H13ClN2O2.C16H11ClN2O3.C16H11ClN2O2.C15H12N4O2.C15H11N3O3.C15H11N3O2/c24-18(11-1-2-11)22-17-9-15(5-6-20-17)27-14-3-4-16-12(8-14)7-13(10-21-16)19(25)23-26;18-15-4-1-11(2-5-15)7-12-3-6-16-13(8-12)9-14(10-19-16)17(21)20-22;17-12-1-3-13(4-2-12)22-14-5-6-15-10(8-14)7-11(9-18-15)16(20)19-21;17-14-4-1-10(2-5-14)11-3-6-15-12(7-11)8-13(9-18-15)16(20)19-21;20-15(19-21)11-7-10-1-2-13(8-14(10)17-9-11)18-12-3-5-16-6-4-12;19-15(18-20)11-7-10-8-13(1-2-14(10)17-9-11)21-12-3-5-16-6-4-12;19-15(18-20)13-7-12-2-1-11(8-14(12)17-9-13)10-3-5-16-6-4-10/h3-11,26H,1-2H2,(H,23,25)(H,20,22,24);1-6,8-10,22H,7H2,(H,20,21);1-9,21H,(H,19,20);1-9,21H,(H,19,20);1-9,21H,(H,16,18)(H,19,20);1-9,20H,(H,18,19);1-9,20H,(H,18,19).
What are the key properties of 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide?
6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide has a molecular weight of 2117.40 g/mol, XLogP of 21.41, 21 rotatable bonds, 16 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenoxy)-N-hydroxyquinoline-3-carboxamide;6-(4-chlorophenyl)-N-hydroxyquinoline-3-carboxamide;6-[(4-chlorophenyl)methyl]-N-hydroxyquinoline-3-carboxamide;6-[[2-(cyclopropanecarbonylamino)-4-pyridinyl]oxy]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(pyridin-4-ylamino)quinoline-3-carboxamide;N-hydroxy-6-pyridin-4-yloxyquinoline-3-carboxamide;N-hydroxy-7-pyridin-4-ylquinoline-3-carboxamide is sourced from PubChem (CID 159159196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).