N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide

C17H20N4O2S — CID 156584738

IUPACN-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCc1sc2nc(CNC(=O)c3ccc(=O)[nH]c3C(C)C)cn2c1C
InChIInChI=1S/C17H20N4O2S/c1-9(2)15-13(5-6-14(22)20-15)16(23)18-7-12-8-21-10(3)11(4)24-17(21)19-12/h5-6,8-9H,7H2,1-4H3,(H,18,23)(H,20,22)
InChIKeyMUKHIBKFHYQSLV-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.75
Rot. Bonds4

About N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide

N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide (PubChem CID 156584738) has the molecular formula C17H20N4O2S and a molecular weight of 344.44 g/mol. Its IUPAC name is N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
PubChem CID156584738
Molecular FormulaC17H20N4O2S
Molecular Weight344.44 g/mol
Exact Mass344.13
IUPAC NameN-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCc1sc2nc(CNC(=O)c3ccc(=O)[nH]c3C(C)C)cn2c1C
InChIInChI=1S/C17H20N4O2S/c1-9(2)15-13(5-6-14(22)20-15)16(23)18-7-12-8-21-10(3)11(4)24-17(21)19-12/h5-6,8-9H,7H2,1-4H3,(H,18,23)(H,20,22)
InChIKeyMUKHIBKFHYQSLV-UHFFFAOYSA-N
XLogP2.75
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 119059165
N-[(4-cyanophenyl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
CID 157019112
N-[1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
CID 157012975
N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]triazole-4-carboxamide
CID 42592532
N-[[5-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
CID 157012402
N-methyl-6-oxo-2-propan-2-yl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1H-pyridine-3-carboxamide
CID 156585739
N-[2-(3-benzyl-1,2,4-oxadiazol-5-yl)ethyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide
CID 157010924
6-methyl-4-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1H-pyridine-3-carboxamide
CID 126799862
1-(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]methanamine
CID 46983148
N-[[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-2-yl]methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 90547400
2-methyl-N-[(5-methyl-1,3-oxazol-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 75395397
N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-5-(2-methylphenyl)-1,2,4-triazin-3-amine
CID 25287488

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide (CID 156584738) is N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide is Cc1sc2nc(CNC(=O)c3ccc(=O)[nH]c3C(C)C)cn2c1C.
What is the InChIKey of N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
The InChIKey is MUKHIBKFHYQSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2S/c1-9(2)15-13(5-6-14(22)20-15)16(23)18-7-12-8-21-10(3)11(4)24-17(21)19-12/h5-6,8-9H,7H2,1-4H3,(H,18,23)(H,20,22).
What are the key properties of N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide?
N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide has a molecular weight of 344.44 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 156584738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).