N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine

C70H72N18O12 — CID 158263965

IUPACN-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
SMILESCOc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)n2c1.NOC1CCCCO1
InChIInChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-23(31-15-19(33-2)10-11-21(31)27-16)20-12-13-26-25(29-20)28-18-8-6-17(7-9-18)24(32)30-35-22-5-3-4-14-34-22;1-12-18(26-11-15(29-2)7-8-17(26)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(27)25-28;1-12-18(25-11-15(28-2)7-8-17(25)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(26)27;6-8-5-3-1-2-4-7-5/h6-13,15,22H,3-5,14H2,1-2H3,(H,30,32)(H,26,28,29);3-11,28H,1-2H3,(H,25,27)(H,21,23,24);3-11H,1-2H3,(H,26,27)(H,21,23,24);5H,1-4,6H2
InChIKeyGIFCJOPWEPVOLO-UHFFFAOYSA-N
MW1357.46 g/mol
LogP10.96
Rot. Bonds18

About N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine

N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine (PubChem CID 158263965) has the molecular formula C70H72N18O12 and a molecular weight of 1357.46 g/mol. Its IUPAC name is N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
PubChem CID158263965
Molecular FormulaC70H72N18O12
Molecular Weight1357.46 g/mol
Exact Mass1356.56
IUPAC NameN-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
SMILESCOc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)n2c1.NOC1CCCCO1
InChIInChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-23(31-15-19(33-2)10-11-21(31)27-16)20-12-13-26-25(29-20)28-18-8-6-17(7-9-18)24(32)30-35-22-5-3-4-14-34-22;1-12-18(26-11-15(29-2)7-8-17(26)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(27)25-28;1-12-18(25-11-15(28-2)7-8-17(25)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(26)27;6-8-5-3-1-2-4-7-5/h6-13,15,22H,3-5,14H2,1-2H3,(H,30,32)(H,26,28,29);3-11,28H,1-2H3,(H,25,27)(H,21,23,24);3-11H,1-2H3,(H,26,27)(H,21,23,24);5H,1-4,6H2
InChIKeyGIFCJOPWEPVOLO-UHFFFAOYSA-N
XLogP10.96
TPSA371.69 Ų
H-Bond Donors8
H-Bond Acceptors27
Rotatable Bonds18
Heavy Atoms100
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001357.46
LogP ≤ 510.96
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine with MolForge

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Related Compounds

N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)-(2,2,2-trifluoroethyl)amino]benzamide;benzene-1,2-diamine;ethyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;ethyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)-(2,2,2-trifluoroethyl)amino]benzoate;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)-(2,2,2-trifluoroethyl)amino]benzamide;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)-(2,2,2-trifluoroethyl)amino]benzoic acid;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)-(2,2,2-trifluoroethyl)amino]-N-(oxan-2-yloxy)benzamide
CID 158779810
(E)-4-((2-(4-((((4-((6-methylpyrazin-2-yl)oxy)benzylidene)amino)oxy)methyl)phenyl)-7-phenylimidazo[1,2-a]pyridin-3-yl)amino)benzoic acid
CID 174155408
(Z)-4-((6-((((4-((6-Methylpyrazin-2-yl)oxy)benzylidene)amino)oxy)methyl)-2-phenylimidazo[1,2-a]pyridin-3-yl)amino)benzoic acid
CID 174155441
(Z)-4-((2-(4-((((4-((6-methylpyrazin-2-yl)oxy)benzylidene)amino)oxy)methyl)phenyl)-7-phenylimidazo[1,2-a]pyridin-3-yl)amino)benzoic acid
CID 174155457
(E)-4-((6-((((4-((6-methylpyrazin-2-yl)oxy)benzylidene)amino)oxy)methyl)-2-phenylimidazo[1,2-a]pyridin-3-yl)amino)benzoic acid
CID 175664944
Methyl 4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
CID 59176858
4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide
CID 59176862
4-[[4-[6-(Methoxymethoxy)-2-methylimidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]benzoic acid
CID 59176874
4-[[4-(8-Methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidinyl]amino]benzoic acid
CID 59176879
4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide
CID 59176891
Methyl 4-((4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl)amino)benzoate
CID 59176900
4-[[4-(6-Methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidinyl]amino]benzoic acid
CID 59176905

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine?
The IUPAC name of N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine (CID 158263965) is N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine.
What is the SMILES notation for N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine?
The canonical SMILES for N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine is COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)n2c1.COc1ccc2nc(C)c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)n2c1.NOC1CCCCO1.
What is the InChIKey of N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine?
The InChIKey is GIFCJOPWEPVOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-23(31-15-19(33-2)10-11-21(31)27-16)20-12-13-26-25(29-20)28-18-8-6-17(7-9-18)24(32)30-35-22-5-3-4-14-34-22;1-12-18(26-11-15(29-2)7-8-17(26)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(27)25-28;1-12-18(25-11-15(28-2)7-8-17(25)22-12)16-9-10-21-20(24-16)23-14-5-3-13(4-6-14)19(26)27;6-8-5-3-1-2-4-7-5/h6-13,15,22H,3-5,14H2,1-2H3,(H,30,32)(H,26,28,29);3-11,28H,1-2H3,(H,25,27)(H,21,23,24);3-11H,1-2H3,(H,26,27)(H,21,23,24);5H,1-4,6H2.
What are the key properties of N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine?
N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine has a molecular weight of 1357.46 g/mol, XLogP of 10.96, 18 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(6-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine is sourced from PubChem (CID 158263965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).