2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide

C19H18FN3O3S — CID 87419945

IUPAC2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3ccc(F)cc3)nc(OC(C)C)c2)n1
InChIInChI=1S/C19H18FN3O3S/c1-11(2)25-16-8-13(18(24)23-19-21-12(3)10-27-19)9-17(22-16)26-15-6-4-14(20)5-7-15/h4-11H,1-3H3,(H,21,23,24)
InChIKeyHUXNBMHNQLGEFD-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.82
Rot. Bonds6

About 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide

2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide (PubChem CID 87419945) has the molecular formula C19H18FN3O3S and a molecular weight of 387.44 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
PubChem CID87419945
Molecular FormulaC19H18FN3O3S
Molecular Weight387.44 g/mol
Exact Mass387.11
IUPAC Name2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3ccc(F)cc3)nc(OC(C)C)c2)n1
InChIInChI=1S/C19H18FN3O3S/c1-11(2)25-16-8-13(18(24)23-19-21-12(3)10-27-19)9-17(22-16)26-15-6-4-14(20)5-7-15/h4-11H,1-3H3,(H,21,23,24)
InChIKeyHUXNBMHNQLGEFD-UHFFFAOYSA-N
XLogP4.82
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2S)-1-methoxypropan-2-yl]oxy-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
CID 143828242
2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
CID 143828211
2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 87419854
2-(1-methoxypropan-2-yloxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-(1-phenylpropan-2-yloxy)pyridine-4-carboxamide
CID 87420038
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46674292
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
3-(1-cyclopropylethoxy)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 88531935
5-chloro-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-3-carboxamide
CID 47293511
3-[(2S)-1-hydroxypropan-2-yl]oxy-5-(4-methylsulfonylphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 11719585
ethyl 2-[2-[[2-(1,3-difluoropropan-2-yloxy)-6-propan-2-yloxypyridine-4-carbonyl]amino]-1,3-thiazol-4-yl]acetate
CID 87420005
2-[2-[[2-[(2R)-1-hydroxypropan-2-yl]oxy-6-(4-methylsulfonylphenoxy)pyridine-4-carbonyl]amino]-1,3-thiazol-4-yl]acetic acid
CID 87420004
4-[(2-methylpropan-2-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 110761812

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide (CID 87419945) is 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide is Cc1csc(NC(=O)c2cc(Oc3ccc(F)cc3)nc(OC(C)C)c2)n1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
The InChIKey is HUXNBMHNQLGEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3S/c1-11(2)25-16-8-13(18(24)23-19-21-12(3)10-27-19)9-17(22-16)26-15-6-4-14(20)5-7-15/h4-11H,1-3H3,(H,21,23,24).
What are the key properties of 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide?
2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide has a molecular weight of 387.44 g/mol, XLogP of 4.82, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide is sourced from PubChem (CID 87419945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).