2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide

C18H15ClN2OS — CID 35343924

IUPAC2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
SMILESO=C(NCCc1csc(-c2ccccc2)n1)c1ccccc1Cl
InChIInChI=1S/C18H15ClN2OS/c19-16-9-5-4-8-15(16)17(22)20-11-10-14-12-23-18(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,22)
InChIKeyGZVDCOJDACTOPE-UHFFFAOYSA-N
MW342.85 g/mol
LogP4.44
Rot. Bonds5

About 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide

2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide (PubChem CID 35343924) has the molecular formula C18H15ClN2OS and a molecular weight of 342.85 g/mol. Its IUPAC name is 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
PubChem CID35343924
Molecular FormulaC18H15ClN2OS
Molecular Weight342.85 g/mol
Exact Mass342.06
IUPAC Name2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
SMILESO=C(NCCc1csc(-c2ccccc2)n1)c1ccccc1Cl
InChIInChI=1S/C18H15ClN2OS/c19-16-9-5-4-8-15(16)17(22)20-11-10-14-12-23-18(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,22)
InChIKeyGZVDCOJDACTOPE-UHFFFAOYSA-N
XLogP4.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.85
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 7119106
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 16032033
2-chloro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 853310
2-chloro-6-fluoro-N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}benzamide
CID 7522100
2-chloro-N-[3-[(4-methyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]benzamide
CID 2523205
4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(dimethylamino)propyl]benzamide
CID 3734285
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
CID 5310230
2-chloro-6-fluoro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 7119113
N-(2-(2-(4-chlorophenyl)-1,3-thiazol-4-yl)ethyl)butanamide
CID 7518316
2,6-difluoro-N-(2-(2-phenylthiazol-4-yl)ethyl)benzamide
CID 16194573
3-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 22583819
N-(2-(2-phenylthiazol-4-yl)ethyl)cyclohexanecarboxamide
CID 22583820

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide (CID 35343924) is 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide is O=C(NCCc1csc(-c2ccccc2)n1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide?
The InChIKey is GZVDCOJDACTOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2OS/c19-16-9-5-4-8-15(16)17(22)20-11-10-14-12-23-18(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,22).
What are the key properties of 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide?
2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide has a molecular weight of 342.85 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide is sourced from PubChem (CID 35343924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).