7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide

C85H95N17O11 — CID 158270018

IUPAC7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide
SMILESCC(C)N1CCC(C(=O)Nc2cc(Oc3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.CCN1CCC(C)(C(=O)Nc2cc(-c3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.O=C(NO)c1ccc2cc(-c3ccnc(C4CCNCC4)c3)ccc2n1.O=C(NO)c1cnc2cc(CCC3CCNCC3)ccc2c1
InChIInChI=1S/C24H27N5O4.C24H27N5O3.C20H20N4O2.C17H21N3O2/c1-15(2)29-9-6-16(7-10-29)23(30)27-22-13-20(5-8-25-22)33-19-4-3-17-11-18(24(31)28-32)14-26-21(17)12-19;1-3-29-10-7-24(2,8-11-29)23(31)27-21-14-17(6-9-25-21)16-4-5-18-12-19(22(30)28-32)15-26-20(18)13-16;25-20(24-26)18-4-2-16-11-14(1-3-17(16)23-18)15-7-10-22-19(12-15)13-5-8-21-9-6-13;21-17(20-22)15-10-14-4-3-13(9-16(14)19-11-15)2-1-12-5-7-18-8-6-12/h3-5,8,11-16,32H,6-7,9-10H2,1-2H3,(H,28,31)(H,25,27,30);4-6,9,12-15,32H,3,7-8,10-11H2,1-2H3,(H,28,30)(H,25,27,31);1-4,7,10-13,21,26H,5-6,8-9H2,(H,24,25);3-4,9-12,18,22H,1-2,5-8H2,(H,20,21)
InChIKeyGIXKBJCZYUFVHP-UHFFFAOYSA-N
MW1530.80 g/mol
LogP12.25
Rot. Bonds18

About 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide

7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide (PubChem CID 158270018) has the molecular formula C85H95N17O11 and a molecular weight of 1530.80 g/mol. Its IUPAC name is 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide.

Molecular Properties

Compound Name7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide
PubChem CID158270018
Molecular FormulaC85H95N17O11
Molecular Weight1530.80 g/mol
Exact Mass1529.74
IUPAC Name7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide
SMILESCC(C)N1CCC(C(=O)Nc2cc(Oc3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.CCN1CCC(C)(C(=O)Nc2cc(-c3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.O=C(NO)c1ccc2cc(-c3ccnc(C4CCNCC4)c3)ccc2n1.O=C(NO)c1cnc2cc(CCC3CCNCC3)ccc2c1
InChIInChI=1S/C24H27N5O4.C24H27N5O3.C20H20N4O2.C17H21N3O2/c1-15(2)29-9-6-16(7-10-29)23(30)27-22-13-20(5-8-25-22)33-19-4-3-17-11-18(24(31)28-32)14-26-21(17)12-19;1-3-29-10-7-24(2,8-11-29)23(31)27-21-14-17(6-9-25-21)16-4-5-18-12-19(22(30)28-32)15-26-20(18)13-16;25-20(24-26)18-4-2-16-11-14(1-3-17(16)23-18)15-7-10-22-19(12-15)13-5-8-21-9-6-13;21-17(20-22)15-10-14-4-3-13(9-16(14)19-11-15)2-1-12-5-7-18-8-6-12/h3-5,8,11-16,32H,6-7,9-10H2,1-2H3,(H,28,31)(H,25,27,30);4-6,9,12-15,32H,3,7-8,10-11H2,1-2H3,(H,28,30)(H,25,27,31);1-4,7,10-13,21,26H,5-6,8-9H2,(H,24,25);3-4,9-12,18,22H,1-2,5-8H2,(H,20,21)
InChIKeyGIXKBJCZYUFVHP-UHFFFAOYSA-N
XLogP12.25
TPSA385.52 Ų
H-Bond Donors12
H-Bond Acceptors22
Rotatable Bonds18
Heavy Atoms113
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001530.80
LogP ≤ 512.25
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide with MolForge

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Related Compounds

N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[[4-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 155277981
N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[2-[4-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]piperazin-1-yl]ethyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 155278023
N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[[4-[2-[(3S)-2,6-dioxopiperidin-3-yl]-6-fluoro-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 155278028
N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[[4-[2-(2,6-dioxopiperidin-3-yl)-6-fluoro-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 155278030
N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[[4-[2-(2,6-dioxopiperidin-3-yl)-6-fluoro-1,3-dioxoisoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 155278048
N-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-6-[4-[[4-[2-(2,6-dioxopiperidin-3-yl)-6-fluoro-1,3-dioxoisoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 155278073
6-[4-[[4-[2-[(3S)-1-[3-(8-cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-2,6-dioxopiperidin-3-yl]-6-fluoro-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 155640113
6-[4-[2-[4-[2-[1-[3-(8-Cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-2,6-dioxopiperidin-3-yl]-1,3-dioxoisoindol-5-yl]piperazin-1-yl]ethyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 155640121
6-[4-[[4-[2-[1-[3-(8-Cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-2,6-dioxopiperidin-3-yl]-6-fluoro-1,3-dioxoisoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 155640131
6-[4-[[4-[2-[1-[3-(8-Cyanoquinolin-5-yl)oxy-2,2,4,4-tetramethylcyclobutyl]-2,6-dioxopiperidin-3-yl]-1,3-dioxoisoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 155640160
N-[4-(8-cyanoquinolin-5-yl)oxycyclohexyl]-6-[4-[[4-[2-[(3S)-2,6-dioxopiperidin-3-yl]-6-fluoro-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 156173806
N-[4-(8-cyanoquinolin-5-yl)oxycyclohexyl]-6-[4-[[4-[2-(2,6-dioxopiperidin-3-yl)-6-fluoro-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidin-1-yl]-5-fluoropyridine-3-carboxamide
CID 156173808

Frequently Asked Questions

What is the IUPAC name of 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide?
The IUPAC name of 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide (CID 158270018) is 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide.
What is the SMILES notation for 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide?
The canonical SMILES for 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide is CC(C)N1CCC(C(=O)Nc2cc(Oc3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.CCN1CCC(C)(C(=O)Nc2cc(-c3ccc4cc(C(=O)NO)cnc4c3)ccn2)CC1.O=C(NO)c1ccc2cc(-c3ccnc(C4CCNCC4)c3)ccc2n1.O=C(NO)c1cnc2cc(CCC3CCNCC3)ccc2c1.
What is the InChIKey of 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide?
The InChIKey is GIXKBJCZYUFVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N5O4.C24H27N5O3.C20H20N4O2.C17H21N3O2/c1-15(2)29-9-6-16(7-10-29)23(30)27-22-13-20(5-8-25-22)33-19-4-3-17-11-18(24(31)28-32)14-26-21(17)12-19;1-3-29-10-7-24(2,8-11-29)23(31)27-21-14-17(6-9-25-21)16-4-5-18-12-19(22(30)28-32)15-26-20(18)13-16;25-20(24-26)18-4-2-16-11-14(1-3-17(16)23-18)15-7-10-22-19(12-15)13-5-8-21-9-6-13;21-17(20-22)15-10-14-4-3-13(9-16(14)19-11-15)2-1-12-5-7-18-8-6-12/h3-5,8,11-16,32H,6-7,9-10H2,1-2H3,(H,28,31)(H,25,27,30);4-6,9,12-15,32H,3,7-8,10-11H2,1-2H3,(H,28,30)(H,25,27,31);1-4,7,10-13,21,26H,5-6,8-9H2,(H,24,25);3-4,9-12,18,22H,1-2,5-8H2,(H,20,21).
What are the key properties of 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide?
7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide has a molecular weight of 1530.80 g/mol, XLogP of 12.25, 18 rotatable bonds, 12 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-[(1-ethyl-4-methylpiperidine-4-carbonyl)amino]-4-pyridinyl]-N-hydroxyquinoline-3-carboxamide;N-hydroxy-7-(2-piperidin-4-ylethyl)quinoline-3-carboxamide;N-hydroxy-6-(2-piperidin-4-yl-4-pyridinyl)quinoline-2-carboxamide;N-hydroxy-7-[[2-[(1-propan-2-ylpiperidine-4-carbonyl)amino]-4-pyridinyl]oxy]quinoline-3-carboxamide is sourced from PubChem (CID 158270018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).