N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide

C15H13N3O2S — CID 2614067

IUPACN-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESCc1ccccc1NC(=O)COc1ncnc2sccc12
InChIInChI=1S/C15H13N3O2S/c1-10-4-2-3-5-12(10)18-13(19)8-20-14-11-6-7-21-15(11)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyMMKBEUDLMSKFKH-UHFFFAOYSA-N
MW299.36 g/mol
LogP3.02
Rot. Bonds4

About N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide

N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (PubChem CID 2614067) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
PubChem CID2614067
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC NameN-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESCc1ccccc1NC(=O)COc1ncnc2sccc12
InChIInChI=1S/C15H13N3O2S/c1-10-4-2-3-5-12(10)18-13(19)8-20-14-11-6-7-21-15(11)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyMMKBEUDLMSKFKH-UHFFFAOYSA-N
XLogP3.02
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chlorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2705204
N-propyl-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2469755
N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2705200
N-[(2R)-3-methylbutan-2-yl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2536928
N-[(2-methoxyphenyl)methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2705199
2-thieno[2,3-d]pyrimidin-4-yloxyacetic acid
CID 115596203
N-(2-methylphenyl)-2-(8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-3-yloxy)acetamide
CID 112776065
N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 5217799
N-[(2R)-1-methoxypropan-2-yl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2474930
N-(2-methylcyclohexyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 3249198
2-(6-bromoquinazolin-4-yl)oxy-N-(2,3-dimethylphenyl)acetamide
CID 2576960
2-(2-benzoylthiophen-3-yl)oxy-N-(2-methylphenyl)acetamide
CID 11703068

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The IUPAC name of N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (CID 2614067) is N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.
What is the SMILES notation for N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The canonical SMILES for N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is Cc1ccccc1NC(=O)COc1ncnc2sccc12.
What is the InChIKey of N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The InChIKey is MMKBEUDLMSKFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c1-10-4-2-3-5-12(10)18-13(19)8-20-14-11-6-7-21-15(11)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19).
What are the key properties of N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide has a molecular weight of 299.36 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is sourced from PubChem (CID 2614067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).