2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide

C11H10N2OS2 — CID 2303777

IUPAC2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1ccccc1)Nc1nccs1
InChIInChI=1S/C11H10N2OS2/c14-10(13-11-12-6-7-15-11)8-16-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13,14)
InChIKeyJCNDQJBJFUDXGT-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.87
Rot. Bonds4

About 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide

2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 2303777) has the molecular formula C11H10N2OS2 and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide
PubChem CID2303777
Molecular FormulaC11H10N2OS2
Molecular Weight250.35 g/mol
Exact Mass250.02
IUPAC Name2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1ccccc1)Nc1nccs1
InChIInChI=1S/C11H10N2OS2/c14-10(13-11-12-6-7-15-11)8-16-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13,14)
InChIKeyJCNDQJBJFUDXGT-UHFFFAOYSA-N
XLogP2.87
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Phenyl-N-(1,3-thiazol-2-yl)propanamide
CID 567867
4-phenyl-N-(1,3-thiazol-2-yl)butanamide
CID 3310551
2-[(2-aminophenyl)thio]-N-1,3-thiazol-2-ylacetamide
CID 859493
2-(benzenesulfonyl)-N-(1,3-thiazol-2-yl)acetamide
CID 2991996
3-(4-methylphenyl)sulfanyl-N-(1,3-thiazol-2-yl)propanamide
CID 7254594
Acetamide, 2-(4-chlorobenzylsulfanyl)-N-thiazol-2-yl-
CID 709144
2-Phenylcarbamoylmethylsulfanyl-N-thiazol-2-yl-acetamide
CID 651375
2-[(2,6-dichlorobenzyl)thio]-N-1,3-thiazol-2-ylacetamide
CID 977945
(Z)-3-phenyl-N-(1,3-thiazol-2-yl)prop-2-enamide
CID 1555760
2-methyl-3-phenyl-N-1,3-thiazol-2-ylacrylamide
CID 2189305
3-phenyl-N-1,3-thiazol-2-yl-2-butenamide
CID 2191773
(E)-3-(3-fluorophenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
CID 2666608

Frequently Asked Questions

What is the IUPAC name of 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide (CID 2303777) is 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide is O=C(CSc1ccccc1)Nc1nccs1.
What is the InChIKey of 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is JCNDQJBJFUDXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2OS2/c14-10(13-11-12-6-7-15-11)8-16-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13,14).
What are the key properties of 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide?
2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 250.35 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylsulfanyl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2303777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).