N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide

C16H10ClN3O2S2 — CID 35721988

IUPACN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1nc(-c2ccc(Cl)s2)cs1
InChIInChI=1S/C16H10ClN3O2S2/c17-14-6-5-13(24-14)11-9-23-16(19-11)20-15(21)8-22-12-4-2-1-3-10(12)7-18/h1-6,9H,8H2,(H,19,20,21)
InChIKeySXKVPABURLBXQZ-UHFFFAOYSA-N
MW375.86 g/mol
LogP4.41
Rot. Bonds5

About N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide

N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide (PubChem CID 35721988) has the molecular formula C16H10ClN3O2S2 and a molecular weight of 375.86 g/mol. Its IUPAC name is N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide
PubChem CID35721988
Molecular FormulaC16H10ClN3O2S2
Molecular Weight375.86 g/mol
Exact Mass374.99
IUPAC NameN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1nc(-c2ccc(Cl)s2)cs1
InChIInChI=1S/C16H10ClN3O2S2/c17-14-6-5-13(24-14)11-9-23-16(19-11)20-15(21)8-22-12-4-2-1-3-10(12)7-18/h1-6,9H,8H2,(H,19,20,21)
InChIKeySXKVPABURLBXQZ-UHFFFAOYSA-N
XLogP4.41
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.86
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-cyanophenoxy)acetamide
CID 8780817
[2-oxo-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl] 2-(2-cyanophenoxy)acetate
CID 23764293
2-(2-cyanophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 18292317
2-(2-cyanophenoxy)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)acetamide
CID 26723131
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 4968210
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-5-cyano-6-methylpyridine-2-carboxamide
CID 39090732
2-(2-cyanophenoxy)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 9247174
2-(2-cyanophenoxy)-N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]acetamide
CID 30186109
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2,6-dimethoxybenzamide
CID 4224171
2-(2-cyanophenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide
CID 7733369
2-(2-chlorophenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 19178554
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2-(4-cyanophenoxy)acetamide
CID 2428133

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide?
The IUPAC name of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide (CID 35721988) is N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide.
What is the SMILES notation for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide?
The canonical SMILES for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide is N#Cc1ccccc1OCC(=O)Nc1nc(-c2ccc(Cl)s2)cs1.
What is the InChIKey of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide?
The InChIKey is SXKVPABURLBXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3O2S2/c17-14-6-5-13(24-14)11-9-23-16(19-11)20-15(21)8-22-12-4-2-1-3-10(12)7-18/h1-6,9H,8H2,(H,19,20,21).
What are the key properties of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide?
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide has a molecular weight of 375.86 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(2-cyanophenoxy)acetamide is sourced from PubChem (CID 35721988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).