N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide

C21H18N4O2S — CID 44623260

IUPACN-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide
SMILESCc1sc(C2(c3ccc(C(=O)NO)cc3)CC2)nc1-c1cnc2ccccn12
InChIInChI=1S/C21H18N4O2S/c1-13-18(16-12-22-17-4-2-3-11-25(16)17)23-20(28-13)21(9-10-21)15-7-5-14(6-8-15)19(26)24-27/h2-8,11-12,27H,9-10H2,1H3,(H,24,26)
InChIKeyWXTIYIAZHHQVOB-UHFFFAOYSA-N
MW390.47 g/mol
LogP3.97
Rot. Bonds4

About N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide

N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide (PubChem CID 44623260) has the molecular formula C21H18N4O2S and a molecular weight of 390.47 g/mol. Its IUPAC name is N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide
PubChem CID44623260
Molecular FormulaC21H18N4O2S
Molecular Weight390.47 g/mol
Exact Mass390.12
IUPAC NameN-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide
SMILESCc1sc(C2(c3ccc(C(=O)NO)cc3)CC2)nc1-c1cnc2ccccn12
InChIInChI=1S/C21H18N4O2S/c1-13-18(16-12-22-17-4-2-3-11-25(16)17)23-20(28-13)21(9-10-21)15-7-5-14(6-8-15)19(26)24-27/h2-8,11-12,27H,9-10H2,1H3,(H,24,26)
InChIKeyWXTIYIAZHHQVOB-UHFFFAOYSA-N
XLogP3.97
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.47
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

N-hydroxy-4-[4-[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]oxan-4-yl]benzamide
CID 44623557
N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)cyclopropyl]benzamide
CID 56848273
5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide
CID 58163669
4-[(5-fluoro-4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]-N-hydroxybenzamide
CID 44610994
N-hydroxy-3-[1-[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]benzamide
CID 44623259
N-hydroxy-4-[1-[4-(2-methyl-3-propan-2-ylimidazol-4-yl)-1,3-thiazol-2-yl]cyclopentyl]benzamide
CID 143935338
methane;propan-2-yl 2-chloro-4-imidazo[1,2-a]pyridin-3-ylpyrimidine-5-carboxylate
CID 160803748
methyl 3-[2-[1-[4-(hydroxycarbamoyl)phenyl]cyclopropyl]-1,3-thiazol-4-yl]-2-methylimidazo[1,2-a]pyridine-7-carboxylate
CID 87514257
methyl 4-[4-[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]oxan-4-yl]benzoate
CID 59160950
N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide
CID 89219959
N-(6-amino-2,2-difluorocyclohexyl)-4-imidazo[1,2-a]pyridin-3-yl-5-methylthiophene-2-carboxamide
CID 46842486
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 51329819

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide?
The IUPAC name of N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide (CID 44623260) is N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide?
The canonical SMILES for N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide is Cc1sc(C2(c3ccc(C(=O)NO)cc3)CC2)nc1-c1cnc2ccccn12.
What is the InChIKey of N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide?
The InChIKey is WXTIYIAZHHQVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2S/c1-13-18(16-12-22-17-4-2-3-11-25(16)17)23-20(28-13)21(9-10-21)15-7-5-14(6-8-15)19(26)24-27/h2-8,11-12,27H,9-10H2,1H3,(H,24,26).
What are the key properties of N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide?
N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide has a molecular weight of 390.47 g/mol, XLogP of 3.97, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[1-(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)cyclopropyl]benzamide is sourced from PubChem (CID 44623260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).