4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine

C15H14N2O2S — CID 91390321

IUPAC4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine
SMILESCOc1cc(C)ccc1Oc1ncnc2scc(C)c12
InChIInChI=1S/C15H14N2O2S/c1-9-4-5-11(12(6-9)18-3)19-14-13-10(2)7-20-15(13)17-8-16-14/h4-8H,1-3H3
InChIKeyCVDOSHPTVRZZFH-UHFFFAOYSA-N
MW286.36 g/mol
LogP4.11
Rot. Bonds3

About 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine

4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine (PubChem CID 91390321) has the molecular formula C15H14N2O2S and a molecular weight of 286.36 g/mol. Its IUPAC name is 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine
PubChem CID91390321
Molecular FormulaC15H14N2O2S
Molecular Weight286.36 g/mol
Exact Mass286.08
IUPAC Name4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine
SMILESCOc1cc(C)ccc1Oc1ncnc2scc(C)c12
InChIInChI=1S/C15H14N2O2S/c1-9-4-5-11(12(6-9)18-3)19-14-13-10(2)7-20-15(13)17-8-16-14/h4-8H,1-3H3
InChIKeyCVDOSHPTVRZZFH-UHFFFAOYSA-N
XLogP4.11
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,5-dimethylphenoxy)-5-(4-methylphenyl)thieno[2,3-d]pyrimidine
CID 3487676
N-(2,5-dimethoxyphenyl)-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 57422571
N-[(3-chloro-4-methoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 141056385
4-(2-methoxy-4-methylphenoxy)-5-methyl-5,6-dihydrothieno[2,3-d]pyrimidine
CID 71176406
5-(4-chlorophenyl)-4-(2-methoxyphenoxy)thieno[2,3-d]pyrimidine
CID 1228156
[6-(2-methoxy-4-methylphenoxy)-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80909009
2-(2-methoxy-4-methylphenoxy)pyrimidin-5-amine
CID 61146611
5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 40773451
2-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-4-methylphenol
CID 21011196
5-amino-6-(2-methoxy-4-methylphenoxy)pyridine-3-carbonitrile
CID 103469506
1-[6-(2-methoxy-4-methylphenoxy)-5-methyl-3-pyridinyl]-N-methylmethanamine
CID 80635567
4-(2-methoxy-4-methylphenoxy)-1-(3-methylphenyl)pyrazolo[5,4-d]pyrimidine
CID 8539459

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine?
The IUPAC name of 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine (CID 91390321) is 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine.
What is the SMILES notation for 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine?
The canonical SMILES for 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine is COc1cc(C)ccc1Oc1ncnc2scc(C)c12.
What is the InChIKey of 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine?
The InChIKey is CVDOSHPTVRZZFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S/c1-9-4-5-11(12(6-9)18-3)19-14-13-10(2)7-20-15(13)17-8-16-14/h4-8H,1-3H3.
What are the key properties of 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine?
4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine has a molecular weight of 286.36 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-4-methylphenoxy)-5-methylthieno[2,3-d]pyrimidine is sourced from PubChem (CID 91390321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).