2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide

C13H13ClN2OS — CID 110717557

IUPAC2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
SMILESO=C(Cc1ccccc1Cl)NCCc1cncs1
InChIInChI=1S/C13H13ClN2OS/c14-12-4-2-1-3-10(12)7-13(17)16-6-5-11-8-15-9-18-11/h1-4,8-9H,5-7H2,(H,16,17)
InChIKeyWIMBNXPDLRCEJZ-UHFFFAOYSA-N
MW280.78 g/mol
LogP2.70
Rot. Bonds5

About 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide

2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide (PubChem CID 110717557) has the molecular formula C13H13ClN2OS and a molecular weight of 280.78 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
PubChem CID110717557
Molecular FormulaC13H13ClN2OS
Molecular Weight280.78 g/mol
Exact Mass280.04
IUPAC Name2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
SMILESO=C(Cc1ccccc1Cl)NCCc1cncs1
InChIInChI=1S/C13H13ClN2OS/c14-12-4-2-1-3-10(12)7-13(17)16-6-5-11-8-15-9-18-11/h1-4,8-9H,5-7H2,(H,16,17)
InChIKeyWIMBNXPDLRCEJZ-UHFFFAOYSA-N
XLogP2.70
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.78
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
CID 110717509
2-(2-chlorophenyl)-N-[2-(5-methyl-1,3-oxazol-2-yl)ethyl]acetamide
CID 110660623
2-(2,4-dichlorophenoxy)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
CID 110717511
N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
CID 12841728
2-(2-chlorophenyl)-N-[2-(furan-3-yl)ethyl]acetamide
CID 71798453
N-[2-(4-aminophenyl)ethyl]-2-(2-chlorophenyl)acetamide
CID 61219066
2-(2-chlorophenyl)-N-[2-(1H-pyrrol-3-yl)ethyl]acetamide
CID 110789402
3-bromo-N-[2-(1,3-thiazol-5-yl)ethyl]benzamide
CID 110717489
3,4-dimethyl-N-[2-(1,3-thiazol-5-yl)ethyl]benzamide
CID 110717499
N-[2-(1,3-thiazol-5-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 110717526
N-[2-[[2-(2-chlorophenyl)acetyl]amino]ethyl]-2,2,2-trifluoroacetamide
CID 108932586
N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
CID 110717473

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide (CID 110717557) is 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide is O=C(Cc1ccccc1Cl)NCCc1cncs1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide?
The InChIKey is WIMBNXPDLRCEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2OS/c14-12-4-2-1-3-10(12)7-13(17)16-6-5-11-8-15-9-18-11/h1-4,8-9H,5-7H2,(H,16,17).
What are the key properties of 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide?
2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide has a molecular weight of 280.78 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide is sourced from PubChem (CID 110717557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).