N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide

C17H15N3O2S — CID 110694157

IUPACN-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide
SMILESO=C(CNc1nccs1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C17H15N3O2S/c21-16(12-19-17-18-10-11-23-17)20-14-8-4-5-9-15(14)22-13-6-2-1-3-7-13/h1-11H,12H2,(H,18,19)(H,20,21)
InChIKeyTWACGAWSZCQXEG-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.99
Rot. Bonds6

About N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide

N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide (PubChem CID 110694157) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide
PubChem CID110694157
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide
SMILESO=C(CNc1nccs1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C17H15N3O2S/c21-16(12-19-17-18-10-11-23-17)20-14-8-4-5-9-15(14)22-13-6-2-1-3-7-13/h1-11H,12H2,(H,18,19)(H,20,21)
InChIKeyTWACGAWSZCQXEG-UHFFFAOYSA-N
XLogP3.99
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide?
The IUPAC name of N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide (CID 110694157) is N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide.
What is the SMILES notation for N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide?
The canonical SMILES for N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide is O=C(CNc1nccs1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide?
The InChIKey is TWACGAWSZCQXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c21-16(12-19-17-18-10-11-23-17)20-14-8-4-5-9-15(14)22-13-6-2-1-3-7-13/h1-11H,12H2,(H,18,19)(H,20,21).
What are the key properties of N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide?
N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide has a molecular weight of 325.39 g/mol, XLogP of 3.99, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyphenyl)-2-(1,3-thiazol-2-ylamino)acetamide is sourced from PubChem (CID 110694157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).