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

C19H17N5O2S — CID 89219959

IUPACN-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide
SMILESCc1nc(Nc2ccc(C(=O)NO)cc2)sc1-c1c(C)nc2ccccn12
InChIInChI=1S/C19H17N5O2S/c1-11-16(24-10-4-3-5-15(24)20-11)17-12(2)21-19(27-17)22-14-8-6-13(7-9-14)18(25)23-26/h3-10,26H,1-2H3,(H,21,22)(H,23,25)
InChIKeyYRCNTAPMVPRPNM-UHFFFAOYSA-N
MW379.45 g/mol
LogP3.94
Rot. Bonds4

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

N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide (PubChem CID 89219959) has the molecular formula C19H17N5O2S and a molecular weight of 379.45 g/mol. Its IUPAC name is N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide
PubChem CID89219959
Molecular FormulaC19H17N5O2S
Molecular Weight379.45 g/mol
Exact Mass379.11
IUPAC NameN-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide
SMILESCc1nc(Nc2ccc(C(=O)NO)cc2)sc1-c1c(C)nc2ccccn12
InChIInChI=1S/C19H17N5O2S/c1-11-16(24-10-4-3-5-15(24)20-11)17-12(2)21-19(27-17)22-14-8-6-13(7-9-14)18(25)23-26/h3-10,26H,1-2H3,(H,21,22)(H,23,25)
InChIKeyYRCNTAPMVPRPNM-UHFFFAOYSA-N
XLogP3.94
TPSA91.55 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.45
LogP ≤ 53.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide?
The IUPAC name of N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide (CID 89219959) is N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide.
What is the SMILES notation for N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide?
The canonical SMILES for N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide is Cc1nc(Nc2ccc(C(=O)NO)cc2)sc1-c1c(C)nc2ccccn12.
What is the InChIKey of N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide?
The InChIKey is YRCNTAPMVPRPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2S/c1-11-16(24-10-4-3-5-15(24)20-11)17-12(2)21-19(27-17)22-14-8-6-13(7-9-14)18(25)23-26/h3-10,26H,1-2H3,(H,21,22)(H,23,25).
What are the key properties of N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide?
N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide has a molecular weight of 379.45 g/mol, XLogP of 3.94, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[4-methyl-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]benzamide is sourced from PubChem (CID 89219959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).