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

C15H15N3O2S — CID 61025255

IUPAC2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2nc(N)c3cc(C)sc3n2)cc1OC
InChIInChI=1S/C15H15N3O2S/c1-8-6-10-13(16)17-14(18-15(10)21-8)9-4-5-11(19-2)12(7-9)20-3/h4-7H,1-3H3,(H2,16,17,18)
InChIKeyYMQWZKHPOSJVFQ-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.27
Rot. Bonds3

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

2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 61025255) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID61025255
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2nc(N)c3cc(C)sc3n2)cc1OC
InChIInChI=1S/C15H15N3O2S/c1-8-6-10-13(16)17-14(18-15(10)21-8)9-4-5-11(19-2)12(7-9)20-3/h4-7H,1-3H3,(H2,16,17,18)
InChIKeyYMQWZKHPOSJVFQ-UHFFFAOYSA-N
XLogP3.27
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 61025887
5-(3,4-dimethoxyphenyl)-1H-pyrazolo[4,5-d]pyrimidin-7-amine
CID 141346954
2-(3,4-dimethoxyphenyl)-5-ethyl-6-methylpyrimidin-4-amine
CID 62191896
6-ethyl-2-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 63614813
4-amino-2-(3,4-dimethoxyphenyl)-6-methylpyrimidine-5-carbonitrile
CID 116646948
5-(3,4-dimethoxyphenyl)-2-methyl-1H-imidazol-4-amine
CID 82475498
2-(3,4-dimethoxyphenyl)pyrimidin-5-amine
CID 43142283
2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine
CID 64983821
2-(3,4-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62187794
5-(4-amino-5,6-dimethylpyrimidin-2-yl)-2-methoxyphenol
CID 62202667
2-(3-fluoro-4-methoxyphenyl)-5,6-dimethylpyrimidin-4-amine
CID 65101012
4,7-dimethoxy-2-methyl-1-benzothiophene
CID 22890914

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (CID 61025255) is 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is COc1ccc(-c2nc(N)c3cc(C)sc3n2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is YMQWZKHPOSJVFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-8-6-10-13(16)17-14(18-15(10)21-8)9-4-5-11(19-2)12(7-9)20-3/h4-7H,1-3H3,(H2,16,17,18).
What are the key properties of 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 301.37 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 61025255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).