5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide

C17H14ClN3O3S — CID 52898168

IUPAC5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide
SMILESCc1csc(NC(=O)c2cc(=O)c(OCc3ccc(Cl)cc3)c[nH]2)n1
InChIInChI=1S/C17H14ClN3O3S/c1-10-9-25-17(20-10)21-16(23)13-6-14(22)15(7-19-13)24-8-11-2-4-12(18)5-3-11/h2-7,9H,8H2,1H3,(H,19,22)(H,20,21,23)
InChIKeyLOTBCWJMELLCGL-UHFFFAOYSA-N
MW375.84 g/mol
LogP3.62
Rot. Bonds5

About 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide

5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 52898168) has the molecular formula C17H14ClN3O3S and a molecular weight of 375.84 g/mol. Its IUPAC name is 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide
PubChem CID52898168
Molecular FormulaC17H14ClN3O3S
Molecular Weight375.84 g/mol
Exact Mass375.04
IUPAC Name5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide
SMILESCc1csc(NC(=O)c2cc(=O)c(OCc3ccc(Cl)cc3)c[nH]2)n1
InChIInChI=1S/C17H14ClN3O3S/c1-10-9-25-17(20-10)21-16(23)13-6-14(22)15(7-19-13)24-8-11-2-4-12(18)5-3-11/h2-7,9H,8H2,1H3,(H,19,22)(H,20,21,23)
InChIKeyLOTBCWJMELLCGL-UHFFFAOYSA-N
XLogP3.62
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.84
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide with MolForge

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Related Compounds

N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methoxy-4-oxo-1H-pyridine-2-carboxamide
CID 127254446
5-[(4-chlorophenyl)methoxy]-N-(6-methoxy-3-pyridinyl)-4-oxo-1H-pyridine-2-carboxamide
CID 52898437
4-oxo-N-phenyl-5-phenylmethoxy-1H-pyridine-2-carboxamide
CID 42442472
5-[(4-chlorophenyl)methoxy]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxopyran-2-carboxamide
CID 42227129
N-(3,4-difluorophenyl)-4-oxo-5-phenylmethoxy-1H-pyridine-2-carboxamide
CID 42442345
5-[(4-fluorophenyl)methoxy]-N-(2-methylpropyl)-4-oxo-1H-pyridine-2-carboxamide
CID 42442742
1-[(4-chlorophenyl)methyl]-N-(4-methyl-1,3-thiazol-2-yl)-2-oxopyridine-3-carboxamide
CID 7598102
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-phenylmethoxybenzamide
CID 2463682
ethyl 2-[4-[(4-oxo-5-phenylmethoxy-1H-pyridine-2-carbonyl)amino]phenyl]acetate
CID 123683336
5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2679160
N-(4-fluorophenyl)-4-oxo-5-phenylmethoxy-1H-pyridine-2-carboxamide
CID 42442339
2-[(4-chlorophenyl)methylsulfonyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 17225204

Frequently Asked Questions

What is the IUPAC name of 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide (CID 52898168) is 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide is Cc1csc(NC(=O)c2cc(=O)c(OCc3ccc(Cl)cc3)c[nH]2)n1.
What is the InChIKey of 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is LOTBCWJMELLCGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O3S/c1-10-9-25-17(20-10)21-16(23)13-6-14(22)15(7-19-13)24-8-11-2-4-12(18)5-3-11/h2-7,9H,8H2,1H3,(H,19,22)(H,20,21,23).
What are the key properties of 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide?
5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 375.84 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-chlorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 52898168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).