6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine

C15H15N3O2S — CID 103331770

IUPAC6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cccc(OC)c3)nc(N)nc2s1
InChIInChI=1S/C15H15N3O2S/c1-3-11-8-12-13(17-15(16)18-14(12)21-11)20-10-6-4-5-9(7-10)19-2/h4-8H,3H2,1-2H3,(H2,16,17,18)
InChIKeyMQNNTKCHKIKJJM-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.64
Rot. Bonds4

About 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine

6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331770) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103331770
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cccc(OC)c3)nc(N)nc2s1
InChIInChI=1S/C15H15N3O2S/c1-3-11-8-12-13(17-15(16)18-14(12)21-11)20-10-6-4-5-9(7-10)19-2/h4-8H,3H2,1-2H3,(H2,16,17,18)
InChIKeyMQNNTKCHKIKJJM-UHFFFAOYSA-N
XLogP3.64
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331559
6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331942
6-ethyl-4-(2-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331898
4-(3,5-dimethylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103331829
6-ethyl-4-(3-fluoro-4-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 107171824
4-(5-chloro-2-methylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103332918
[6-ethyl-4-(3-iodophenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336225
4-(4-bromo-2-methylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103332531
4-(2-chloro-4-fluorophenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103331676
4-(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)oxyaniline
CID 39187548
6-ethyl-4-(thiophen-2-ylmethoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332219
2-(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)oxyethanol
CID 103331574

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine (CID 103331770) is 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine is CCc1cc2c(Oc3cccc(OC)c3)nc(N)nc2s1.
What is the InChIKey of 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is MQNNTKCHKIKJJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-3-11-8-12-13(17-15(16)18-14(12)21-11)20-10-6-4-5-9(7-10)19-2/h4-8H,3H2,1-2H3,(H2,16,17,18).
What are the key properties of 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 301.37 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).