6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine

C14H17N5OS — CID 103333513

IUPAC6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cnn(CC)c3)nc(NC)nc2s1
InChIInChI=1S/C14H17N5OS/c1-4-10-6-11-12(17-14(15-3)18-13(11)21-10)20-9-7-16-19(5-2)8-9/h6-8H,4-5H2,1-3H3,(H,15,17,18)
InChIKeyPXHIHMFNEIBXIK-UHFFFAOYSA-N
MW303.39 g/mol
LogP3.30
Rot. Bonds5

About 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine

6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103333513) has the molecular formula C14H17N5OS and a molecular weight of 303.39 g/mol. Its IUPAC name is 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103333513
Molecular FormulaC14H17N5OS
Molecular Weight303.39 g/mol
Exact Mass303.12
IUPAC Name6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(Oc3cnn(CC)c3)nc(NC)nc2s1
InChIInChI=1S/C14H17N5OS/c1-4-10-6-11-12(17-14(15-3)18-13(11)21-10)20-9-7-16-19(5-2)8-9/h6-8H,4-5H2,1-3H3,(H,15,17,18)
InChIKeyPXHIHMFNEIBXIK-UHFFFAOYSA-N
XLogP3.30
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-ethyl-N-methyl-4-[(1-methyl-1,2,4-triazol-3-yl)oxy]thieno[2,3-d]pyrimidin-2-amine
CID 106598650
6-ethyl-N-methyl-4-(3,3,3-trifluoropropoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103333323
6-ethyl-N-methyl-4-(2-thiophen-2-ylethoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332286
[6-ethyl-4-(3-iodophenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336225
4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324155
[4-(1-ethylpyrazol-4-yl)oxyquinazolin-2-yl]hydrazine
CID 116806830
1-[1-(1-ethylpyrazol-4-yl)oxyisoquinolin-3-yl]-N-methylmethanamine
CID 116802822
6-ethyl-2-N-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324044
[6-ethyl-4-[(1-methyl-1,2,4-triazol-3-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 106598874
4-(3,5-dimethylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103331829
6-ethyl-4-(2-methoxyethylsulfanyl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103334389
5-chloro-N-ethyl-4-(1-ethylpyrazol-4-yl)oxypyrimidin-2-amine
CID 116806063

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine (CID 103333513) is 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine is CCc1cc2c(Oc3cnn(CC)c3)nc(NC)nc2s1.
What is the InChIKey of 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is PXHIHMFNEIBXIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5OS/c1-4-10-6-11-12(17-14(15-3)18-13(11)21-10)20-9-7-16-19(5-2)8-9/h6-8H,4-5H2,1-3H3,(H,15,17,18).
What are the key properties of 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 303.39 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(1-ethylpyrazol-4-yl)oxy-N-methylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103333513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).