2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide

C14H16N2O3S — CID 17034258

IUPAC2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide
SMILESCCC(Oc1ccc(OC)cc1)C(=O)Nc1nccs1
InChIInChI=1S/C14H16N2O3S/c1-3-12(13(17)16-14-15-8-9-20-14)19-11-6-4-10(18-2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17)
InChIKeyLYOWDIIZXSROID-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.95
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide

2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide (PubChem CID 17034258) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide
PubChem CID17034258
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide
SMILESCCC(Oc1ccc(OC)cc1)C(=O)Nc1nccs1
InChIInChI=1S/C14H16N2O3S/c1-3-12(13(17)16-14-15-8-9-20-14)19-11-6-4-10(18-2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17)
InChIKeyLYOWDIIZXSROID-UHFFFAOYSA-N
XLogP2.95
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 719476
2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 770967
2-(3-methoxyphenoxy)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 43910258
N-(4-methoxyphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 45000900
N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenoxy)butanamide
CID 133210668
(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide
CID 42082583
2-(4-methoxyphenoxy)-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide
CID 133163990
(2R)-N-ethyl-2-(4-methoxyphenoxy)butanamide
CID 124561354
(2S)-2-(4-methoxyphenoxy)-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide
CID 100601405
N-[5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl]-2-phenoxybutanamide
CID 17321306
2-(4-methoxyphenoxy)-N-(pyridin-2-ylmethyl)butanamide
CID 25252608
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybutanamide
CID 2948680

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide (CID 17034258) is 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide is CCC(Oc1ccc(OC)cc1)C(=O)Nc1nccs1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide?
The InChIKey is LYOWDIIZXSROID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-3-12(13(17)16-14-15-8-9-20-14)19-11-6-4-10(18-2)5-7-11/h4-9,12H,3H2,1-2H3,(H,15,16,17).
What are the key properties of 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide?
2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide has a molecular weight of 292.36 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(1,3-thiazol-2-yl)butanamide is sourced from PubChem (CID 17034258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).