2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide

C18H16FN3O3S — CID 87419854

IUPAC2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
SMILESCC(C)Oc1cc(C(=O)Nc2nccs2)cc(Oc2cccc(F)c2)n1
InChIInChI=1S/C18H16FN3O3S/c1-11(2)24-15-8-12(17(23)22-18-20-6-7-26-18)9-16(21-15)25-14-5-3-4-13(19)10-14/h3-11H,1-2H3,(H,20,22,23)
InChIKeyFFYAYDXTLAVZLC-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.51
Rot. Bonds6

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

2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide (PubChem CID 87419854) has the molecular formula C18H16FN3O3S and a molecular weight of 373.41 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
PubChem CID87419854
Molecular FormulaC18H16FN3O3S
Molecular Weight373.41 g/mol
Exact Mass373.09
IUPAC Name2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
SMILESCC(C)Oc1cc(C(=O)Nc2nccs2)cc(Oc2cccc(F)c2)n1
InChIInChI=1S/C18H16FN3O3S/c1-11(2)24-15-8-12(17(23)22-18-20-6-7-26-18)9-16(21-15)25-14-5-3-4-13(19)10-14/h3-11H,1-2H3,(H,20,22,23)
InChIKeyFFYAYDXTLAVZLC-UHFFFAOYSA-N
XLogP4.51
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-fluorophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-4-carboxamide
CID 87419945
4-propan-2-yloxy-N-(1,3-thiazol-2-yl)benzamide
CID 762358
[3-[3-propan-2-yloxy-5-(1,3-thiazol-2-ylcarbamoyl)phenoxy]phenyl]methylphosphonic acid
CID 58529028
2-(2-cyclohexa-1,3-dien-1-ylethoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 143828240
[2-[3-propan-2-yloxy-5-(1,3-thiazol-2-ylcarbamoyl)phenoxy]pyrimidin-5-yl]phosphonic acid
CID 58528871
3-[3-(2-methoxyethylcarbamoyl)phenoxy]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1,3-thiazol-2-yl)benzamide
CID 58133624
3-[4-(1-hydroxypropyl)phenoxy]-5-propan-2-yloxy-N-(1,3-thiazol-2-yl)benzamide
CID 10431822
2-phenoxy-N-(1,3-thiazol-2-yl)propanamide
CID 4279674
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
methyl N-[[4-[3-propan-2-yloxy-5-(1,3-thiazol-2-ylcarbamoyl)phenoxy]phenyl]methyl]carbamate
CID 23093077
5-(4-propan-2-yloxyphenyl)-N-(1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide
CID 52904574
3-[4-[[2-(methylamino)-2-oxoethyl]carbamoyl]phenoxy]-5-propan-2-yloxy-N-(1,3-thiazol-2-yl)benzamide
CID 11190565

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide (CID 87419854) is 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide is CC(C)Oc1cc(C(=O)Nc2nccs2)cc(Oc2cccc(F)c2)n1.
What is the InChIKey of 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide?
The InChIKey is FFYAYDXTLAVZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O3S/c1-11(2)24-15-8-12(17(23)22-18-20-6-7-26-18)9-16(21-15)25-14-5-3-4-13(19)10-14/h3-11H,1-2H3,(H,20,22,23).
What are the key properties of 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide?
2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide has a molecular weight of 373.41 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-6-propan-2-yloxy-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 87419854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).