N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide

C14H11N3O2S — CID 8933027

IUPACN-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide
SMILESCC(=O)Nc1ccc(Oc2ncnc3sccc23)cc1
InChIInChI=1S/C14H11N3O2S/c1-9(18)17-10-2-4-11(5-3-10)19-13-12-6-7-20-14(12)16-8-15-13/h2-8H,1H3,(H,17,18)
InChIKeyVCFXLHIBKCPRQY-UHFFFAOYSA-N
MW285.33 g/mol
LogP3.44
Rot. Bonds3

About N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide

N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide (PubChem CID 8933027) has the molecular formula C14H11N3O2S and a molecular weight of 285.33 g/mol. Its IUPAC name is N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide
PubChem CID8933027
Molecular FormulaC14H11N3O2S
Molecular Weight285.33 g/mol
Exact Mass285.06
IUPAC NameN-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide
SMILESCC(=O)Nc1ccc(Oc2ncnc3sccc23)cc1
InChIInChI=1S/C14H11N3O2S/c1-9(18)17-10-2-4-11(5-3-10)19-13-12-6-7-20-14(12)16-8-15-13/h2-8H,1H3,(H,17,18)
InChIKeyVCFXLHIBKCPRQY-UHFFFAOYSA-N
XLogP3.44
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)benzamide
CID 9110957
N-pyridin-3-yl-4-thieno[2,3-d]pyrimidin-4-yloxybenzamide
CID 56820177
2-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetic acid
CID 61395524
4-(4-methylsulfanylphenoxy)thieno[2,3-d]pyrimidine
CID 9109087
N-methyl-1-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)methanamine
CID 106486840
2-methyl-4-thieno[2,3-d]pyrimidin-4-yloxybenzoic acid
CID 107672534
4-(4-pyridin-2-yloxyphenoxy)thieno[2,3-d]pyrimidine
CID 51112668
3-thieno[2,3-d]pyrimidin-4-yloxybenzoic acid
CID 61395660
N-[4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)phenyl]acetamide
CID 2620993
2-thieno[2,3-d]pyrimidin-4-yloxyacetic acid
CID 115596203
N-(3,4-dimethoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2614117
N,4-dimethyl-N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)benzenesulfonamide
CID 35885039

Frequently Asked Questions

What is the IUPAC name of N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide?
The IUPAC name of N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide (CID 8933027) is N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide.
What is the SMILES notation for N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide?
The canonical SMILES for N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide is CC(=O)Nc1ccc(Oc2ncnc3sccc23)cc1.
What is the InChIKey of N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide?
The InChIKey is VCFXLHIBKCPRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S/c1-9(18)17-10-2-4-11(5-3-10)19-13-12-6-7-20-14(12)16-8-15-13/h2-8H,1H3,(H,17,18).
What are the key properties of N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide?
N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide has a molecular weight of 285.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-thieno[2,3-d]pyrimidin-4-yloxyphenyl)acetamide is sourced from PubChem (CID 8933027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).