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

C15H13N3O3S — CID 2705200

IUPACN-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESCOc1cccc(NC(=O)COc2ncnc3sccc23)c1
InChIInChI=1S/C15H13N3O3S/c1-20-11-4-2-3-10(7-11)18-13(19)8-21-14-12-5-6-22-15(12)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyRZXOFDQUZBLDBE-UHFFFAOYSA-N
MW315.35 g/mol
LogP2.72
Rot. Bonds5

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

N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (PubChem CID 2705200) has the molecular formula C15H13N3O3S and a molecular weight of 315.35 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
PubChem CID2705200
Molecular FormulaC15H13N3O3S
Molecular Weight315.35 g/mol
Exact Mass315.07
IUPAC NameN-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESCOc1cccc(NC(=O)COc2ncnc3sccc23)c1
InChIInChI=1S/C15H13N3O3S/c1-20-11-4-2-3-10(7-11)18-13(19)8-21-14-12-5-6-22-15(12)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyRZXOFDQUZBLDBE-UHFFFAOYSA-N
XLogP2.72
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (CID 2705200) is N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is COc1cccc(NC(=O)COc2ncnc3sccc23)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The InChIKey is RZXOFDQUZBLDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3S/c1-20-11-4-2-3-10(7-11)18-13(19)8-21-14-12-5-6-22-15(12)17-9-16-14/h2-7,9H,8H2,1H3,(H,18,19).
What are the key properties of N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide has a molecular weight of 315.35 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is sourced from PubChem (CID 2705200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).