N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide

C12H11ClN2O2S — CID 2764068

IUPACN-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1cccc(OCc2cnc(Cl)s2)c1
InChIInChI=1S/C12H11ClN2O2S/c1-8(16)15-9-3-2-4-10(5-9)17-7-11-6-14-12(13)18-11/h2-6H,7H2,1H3,(H,15,16)
InChIKeyPKTGMAZTFQFXEI-UHFFFAOYSA-N
MW282.75 g/mol
LogP3.33
Rot. Bonds4

About N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide

N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide (PubChem CID 2764068) has the molecular formula C12H11ClN2O2S and a molecular weight of 282.75 g/mol. Its IUPAC name is N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide
PubChem CID2764068
Molecular FormulaC12H11ClN2O2S
Molecular Weight282.75 g/mol
Exact Mass282.02
IUPAC NameN-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1cccc(OCc2cnc(Cl)s2)c1
InChIInChI=1S/C12H11ClN2O2S/c1-8(16)15-9-3-2-4-10(5-9)17-7-11-6-14-12(13)18-11/h2-6H,7H2,1H3,(H,15,16)
InChIKeyPKTGMAZTFQFXEI-UHFFFAOYSA-N
XLogP3.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.75
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide?
The IUPAC name of N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide (CID 2764068) is N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide is CC(=O)Nc1cccc(OCc2cnc(Cl)s2)c1.
What is the InChIKey of N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide?
The InChIKey is PKTGMAZTFQFXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2S/c1-8(16)15-9-3-2-4-10(5-9)17-7-11-6-14-12(13)18-11/h2-6H,7H2,1H3,(H,15,16).
What are the key properties of N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide?
N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide has a molecular weight of 282.75 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 2764068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).