2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

C12H10Br2N2O2S — CID 17477090

IUPAC2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cnc(NC(=O)COc2ccc(Br)cc2Br)s1
InChIInChI=1S/C12H10Br2N2O2S/c1-7-5-15-12(19-7)16-11(17)6-18-10-3-2-8(13)4-9(10)14/h2-5H,6H2,1H3,(H,15,16,17)
InChIKeyIVKYOOCTXZRSBL-UHFFFAOYSA-N
MW406.10 g/mol
LogP3.99
Rot. Bonds4

About 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 17477090) has the molecular formula C12H10Br2N2O2S and a molecular weight of 406.10 g/mol. Its IUPAC name is 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID17477090
Molecular FormulaC12H10Br2N2O2S
Molecular Weight406.10 g/mol
Exact Mass403.88
IUPAC Name2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1cnc(NC(=O)COc2ccc(Br)cc2Br)s1
InChIInChI=1S/C12H10Br2N2O2S/c1-7-5-15-12(19-7)16-11(17)6-18-10-3-2-8(13)4-9(10)14/h2-5H,6H2,1H3,(H,15,16,17)
InChIKeyIVKYOOCTXZRSBL-UHFFFAOYSA-N
XLogP3.99
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.10
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dibromophenoxy)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 19171299
N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2,4-dibromophenoxy)acetamide
CID 19217332
N-(5-methyl-1,3-thiazol-2-yl)-2-naphthalen-1-yloxyacetamide
CID 2673025
methyl 2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-1,3-thiazole-5-carboxylate
CID 18103661
2-(2,4-dibromophenoxy)-N-methoxyacetamide
CID 33099382
N-(4-chloro-2-methylphenyl)-2-(2,4-dibromophenoxy)acetamide
CID 1189036
2-(2,4-dibromophenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 2788023
N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-bromo-4-phenylphenoxy)acetamide
CID 19217968
2-(3-acetylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2673036
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
N-(5-methyl-1,3-thiazol-2-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 46491720
2-(2,4-dibromophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 1181190

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 17477090) is 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is Cc1cnc(NC(=O)COc2ccc(Br)cc2Br)s1.
What is the InChIKey of 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is IVKYOOCTXZRSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N2O2S/c1-7-5-15-12(19-7)16-11(17)6-18-10-3-2-8(13)4-9(10)14/h2-5H,6H2,1H3,(H,15,16,17).
What are the key properties of 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 406.10 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dibromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 17477090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).