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

C16H17N3OS — CID 103331559

IUPAC6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cccc(Oc2nc(N)nc3sc(CC)cc23)c1
InChIInChI=1S/C16H17N3OS/c1-3-10-6-5-7-11(8-10)20-14-13-9-12(4-2)21-15(13)19-16(17)18-14/h5-9H,3-4H2,1-2H3,(H2,17,18,19)
InChIKeyGGJOSPJTRLQBHZ-UHFFFAOYSA-N
MW299.40 g/mol
LogP4.19
Rot. Bonds4

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

6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331559) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103331559
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC Name6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cccc(Oc2nc(N)nc3sc(CC)cc23)c1
InChIInChI=1S/C16H17N3OS/c1-3-10-6-5-7-11(8-10)20-14-13-9-12(4-2)21-15(13)19-16(17)18-14/h5-9H,3-4H2,1-2H3,(H2,17,18,19)
InChIKeyGGJOSPJTRLQBHZ-UHFFFAOYSA-N
XLogP4.19
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-4-(3-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331770
6-ethyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331942
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
6-ethyl-4-(2-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331898
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-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine (CID 103331559) is 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine is CCc1cccc(Oc2nc(N)nc3sc(CC)cc23)c1.
What is the InChIKey of 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is GGJOSPJTRLQBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-3-10-6-5-7-11(8-10)20-14-13-9-12(4-2)21-15(13)19-16(17)18-14/h5-9H,3-4H2,1-2H3,(H2,17,18,19).
What are the key properties of 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 299.40 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(3-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).