6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine

C13H12N4OS — CID 103331942

IUPAC6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cccnc3)nc(N)nc2s1
InChIInChI=1S/C13H12N4OS/c1-2-9-6-10-11(16-13(14)17-12(10)19-9)18-8-4-3-5-15-7-8/h3-7H,2H2,1H3,(H2,14,16,17)
InChIKeyIPCKYNQLGXKULX-UHFFFAOYSA-N
MW272.33 g/mol
LogP3.02
Rot. Bonds3

About 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine

6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331942) has the molecular formula C13H12N4OS and a molecular weight of 272.33 g/mol. Its IUPAC name is 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
PubChem CID103331942
Molecular FormulaC13H12N4OS
Molecular Weight272.33 g/mol
Exact Mass272.07
IUPAC Name6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cccnc3)nc(N)nc2s1
InChIInChI=1S/C13H12N4OS/c1-2-9-6-10-11(16-13(14)17-12(10)19-9)18-8-4-3-5-15-7-8/h3-7H,2H2,1H3,(H2,14,16,17)
InChIKeyIPCKYNQLGXKULX-UHFFFAOYSA-N
XLogP3.02
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331770
6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331559
6-methyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331947
4-(3,5-dimethylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103331829
6-ethyl-4-(2-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331898
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
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-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine (CID 103331942) is 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine is CCc1cc2c(Oc3cccnc3)nc(N)nc2s1.
What is the InChIKey of 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine?
The InChIKey is IPCKYNQLGXKULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4OS/c1-2-9-6-10-11(16-13(14)17-12(10)19-9)18-8-4-3-5-15-7-8/h3-7H,2H2,1H3,(H2,14,16,17).
What are the key properties of 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine has a molecular weight of 272.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).