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

C14H9F2N3O2S — CID 2433431

IUPACN-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESO=C(COc1ncnc2sccc12)Nc1ccc(F)cc1F
InChIInChI=1S/C14H9F2N3O2S/c15-8-1-2-11(10(16)5-8)19-12(20)6-21-13-9-3-4-22-14(9)18-7-17-13/h1-5,7H,6H2,(H,19,20)
InChIKeyJVZLUNHUTPYBJB-UHFFFAOYSA-N
MW321.31 g/mol
LogP2.99
Rot. Bonds4

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

N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (PubChem CID 2433431) has the molecular formula C14H9F2N3O2S and a molecular weight of 321.31 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
PubChem CID2433431
Molecular FormulaC14H9F2N3O2S
Molecular Weight321.31 g/mol
Exact Mass321.04
IUPAC NameN-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESO=C(COc1ncnc2sccc12)Nc1ccc(F)cc1F
InChIInChI=1S/C14H9F2N3O2S/c15-8-1-2-11(10(16)5-8)19-12(20)6-21-13-9-3-4-22-14(9)18-7-17-13/h1-5,7H,6H2,(H,19,20)
InChIKeyJVZLUNHUTPYBJB-UHFFFAOYSA-N
XLogP2.99
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.31
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,4-difluorophenyl)-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

Related Compounds

2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy}-N,N-dimethylacetamide
CID 2088075
N-ethyl-2-[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxyacetamide
CID 2117377
N-cyclohexyl-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2128204
N-(2-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 3314351
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thieno[2,3-d]pyrimidin-4-yloxyethanone
CID 2100259
2-[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-N-(2-methoxyethyl)acetamide
CID 2161555
2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
CID 2553837
N-(2,5-dimethoxyphenyl)-2-(6-methylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 6460337
N-methyl-N-phenyl-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2086127
N-ethyl-N-phenyl-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2433509
N,N-dimethyl-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide
CID 4880949
N-(4-methoxyphenyl)-2-(6-methylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 6458060

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (CID 2433431) is N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is O=C(COc1ncnc2sccc12)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The InChIKey is JVZLUNHUTPYBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N3O2S/c15-8-1-2-11(10(16)5-8)19-12(20)6-21-13-9-3-4-22-14(9)18-7-17-13/h1-5,7H,6H2,(H,19,20).
What are the key properties of N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide has a molecular weight of 321.31 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is sourced from PubChem (CID 2433431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).