2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

C15H15N3O2S — CID 103399652

IUPAC2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCNc1nc(-c2cc(OC)cc(OC)c2)nc2sccc12
InChIInChI=1S/C15H15N3O2S/c1-16-14-12-4-5-21-15(12)18-13(17-14)9-6-10(19-2)8-11(7-9)20-3/h4-8H,1-3H3,(H,16,17,18)
InChIKeyQLODFWHFYKVRLM-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.42
Rot. Bonds4

About 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 103399652) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID103399652
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCNc1nc(-c2cc(OC)cc(OC)c2)nc2sccc12
InChIInChI=1S/C15H15N3O2S/c1-16-14-12-4-5-21-15(12)18-13(17-14)9-6-10(19-2)8-11(7-9)20-3/h4-8H,1-3H3,(H,16,17,18)
InChIKeyQLODFWHFYKVRLM-UHFFFAOYSA-N
XLogP3.42
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3,4-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62187794
2-(4-fluorophenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62188533
2-(2-methoxy-4-methylphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 106792983
2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 62188855
2-(3-bromo-4-fluorophenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 82800329
4-chloro-2-(3-methoxyphenyl)thieno[2,3-d]pyrimidine
CID 62178883
4-N-(3,5-dimethoxyphenyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103323394
2-(4-bromo-2-fluorophenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 114907043
2-(2-bromo-6-fluorophenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 114887684
6-methoxy-N-methyl-2-thiophen-3-ylquinazolin-4-amine
CID 64980900
2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 82741495
2-(2-methoxybutan-2-yl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 116775412

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (CID 103399652) is 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is CNc1nc(-c2cc(OC)cc(OC)c2)nc2sccc12.
What is the InChIKey of 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is QLODFWHFYKVRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-16-14-12-4-5-21-15(12)18-13(17-14)9-6-10(19-2)8-11(7-9)20-3/h4-8H,1-3H3,(H,16,17,18).
What are the key properties of 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 301.37 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103399652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).