N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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 161426981

IUPACN-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
SMILESCOc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)c(C)nc12.NOC1CCCCO1
InChIInChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-22(31-14-5-6-20(33-2)23(31)27-16)19-12-13-26-25(29-19)28-18-10-8-17(9-11-18)24(32)30-35-21-7-3-4-15-34-21;1-12-17(26-11-3-4-16(29-2)18(26)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(27)25-28;1-12-17(25-11-3-4-16(28-2)18(25)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(26)27;6-8-5-3-1-2-4-7-5/h5-6,8-14,21H,3-4,7,15H2,1-2H3,(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
InChIKeyVXMIUWGBDSQTDZ-UHFFFAOYSA-N
MW1357.46 g/mol
LogP10.96
Rot. Bonds18

About N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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 161426981) has the molecular formula C70H72N18O12 and a molecular weight of 1357.46 g/mol. Its IUPAC name is N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
PubChem CID161426981
Molecular FormulaC70H72N18O12
Molecular Weight1357.46 g/mol
Exact Mass1356.56
IUPAC NameN-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine
SMILESCOc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)c(C)nc12.NOC1CCCCO1
InChIInChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-22(31-14-5-6-20(33-2)23(31)27-16)19-12-13-26-25(29-19)28-18-10-8-17(9-11-18)24(32)30-35-21-7-3-4-15-34-21;1-12-17(26-11-3-4-16(29-2)18(26)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(27)25-28;1-12-17(25-11-3-4-16(28-2)18(25)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(26)27;6-8-5-3-1-2-4-7-5/h5-6,8-14,21H,3-4,7,15H2,1-2H3,(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
InChIKeyVXMIUWGBDSQTDZ-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)pyrazine-2-carboxamide
CID 59176803
methyl 4-[[4-(8-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
CID 59176913
ethyl 2-chloro-1,3-oxazole-5-carboxylate;ethyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-oxazole-5-carboxylate;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-oxazole-5-carboxamide;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-oxazole-5-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-oxazole-5-carboxylic acid
CID 162089277
4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]-N-methylbenzamide
CID 58163873
4-[[4-(2-methoxyanilino)pyrimidin-2-yl]amino]benzoic acid
CID 70702136
4-[2-[[2-(2-methylmorpholin-4-yl)acetyl]amino]pyrimidin-4-yl]-N-(oxan-2-yloxy)benzamide
CID 178034836
methyl 3-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoate
CID 59176943
[3-(dimethylamino)pyrrolidin-1-yl]-[4-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]phenyl]methanone
CID 68681016
N-(oxan-2-yloxy)-2-phenoxybenzamide
CID 60612521
N-[1-[4-(hydroxycarbamoyl)phenyl]piperidin-4-yl]naphthalene-2-carboxamide;N-[1-[4-(oxan-2-yloxycarbamoyl)phenyl]piperidin-4-yl]naphthalene-2-carboxamide
CID 159718507
4-chloro-N-(oxan-2-yloxy)benzamide
CID 51103118
4-[(4-methoxypyrimidin-2-yl)amino]benzoic acid
CID 43378936

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine (CID 161426981) is N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)benzamide;O-(oxan-2-yl)hydroxylamine is COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NO)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)NOC5CCCCO5)cc4)n3)c(C)nc12.COc1cccn2c(-c3ccnc(Nc4ccc(C(=O)O)cc4)n3)c(C)nc12.NOC1CCCCO1.
What is the InChIKey of N-hydroxy-4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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 VXMIUWGBDSQTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O4.C20H18N6O3.C20H17N5O3.C5H11NO2/c1-16-22(31-14-5-6-20(33-2)23(31)27-16)19-12-13-26-25(29-19)28-18-10-8-17(9-11-18)24(32)30-35-21-7-3-4-15-34-21;1-12-17(26-11-3-4-16(29-2)18(26)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(27)25-28;1-12-17(25-11-3-4-16(28-2)18(25)22-12)15-9-10-21-20(24-15)23-14-7-5-13(6-8-14)19(26)27;6-8-5-3-1-2-4-7-5/h5-6,8-14,21H,3-4,7,15H2,1-2H3,(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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzamide;4-[[4-(8-methoxy-2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]benzoic acid;4-[[4-(8-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 161426981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).