4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine

C15H15N3OS — CID 103331767

IUPAC4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(Oc3cccc(C)c3C)nc(N)nc2s1
InChIInChI=1S/C15H15N3OS/c1-8-5-4-6-12(10(8)3)19-13-11-7-9(2)20-14(11)18-15(16)17-13/h4-7H,1-3H3,(H2,16,17,18)
InChIKeyGKZDNBZSEJOPMX-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.99
Rot. Bonds2

About 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine

4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331767) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103331767
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(Oc3cccc(C)c3C)nc(N)nc2s1
InChIInChI=1S/C15H15N3OS/c1-8-5-4-6-12(10(8)3)19-13-11-7-9(2)20-14(11)18-15(16)17-13/h4-7H,1-3H3,(H2,16,17,18)
InChIKeyGKZDNBZSEJOPMX-UHFFFAOYSA-N
XLogP3.99
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-chloro-2-fluorophenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103333496
4-(2-ethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332009
4-(4-bromo-2-methylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332537
6-methyl-4-pyridin-3-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331947
4-(4-fluoro-3-methylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103333166
4-(2-chloro-4-methylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332445
4-(2-bromo-4-chlorophenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103331934
4-(5-bromo-2-chlorophenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332585
6-methyl-4-(4-methylsulfanylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332557
4-[(3-chlorophenyl)methoxy]-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332823
6-methyl-4-(4,4,4-trifluorobutoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103333279
6-ethyl-4-(2-methoxyphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331898

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine (CID 103331767) is 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine is Cc1cc2c(Oc3cccc(C)c3C)nc(N)nc2s1.
What is the InChIKey of 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is GKZDNBZSEJOPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-8-5-4-6-12(10(8)3)19-13-11-7-9(2)20-14(11)18-15(16)17-13/h4-7H,1-3H3,(H2,16,17,18).
What are the key properties of 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine?
4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 285.37 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylphenoxy)-6-methylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).