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

C16H24N4S — CID 103330512

IUPAC4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(N3CCC(C)C(C)C3)nc(NC)nc2s1
InChIInChI=1S/C16H24N4S/c1-5-12-8-13-14(18-16(17-4)19-15(13)21-12)20-7-6-10(2)11(3)9-20/h8,10-11H,5-7,9H2,1-4H3,(H,17,18,19)
InChIKeyINJUFBLLGXKNHS-UHFFFAOYSA-N
MW304.46 g/mol
LogP3.78
Rot. Bonds3

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

4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103330512) has the molecular formula C16H24N4S and a molecular weight of 304.46 g/mol. Its IUPAC name is 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103330512
Molecular FormulaC16H24N4S
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Name4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(N3CCC(C)C(C)C3)nc(NC)nc2s1
InChIInChI=1S/C16H24N4S/c1-5-12-8-13-14(18-16(17-4)19-15(13)21-12)20-7-6-10(2)11(3)9-20/h8,10-11H,5-7,9H2,1-4H3,(H,17,18,19)
InChIKeyINJUFBLLGXKNHS-UHFFFAOYSA-N
XLogP3.78
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine (CID 103330512) is 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine is CCc1cc2c(N3CCC(C)C(C)C3)nc(NC)nc2s1.
What is the InChIKey of 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is INJUFBLLGXKNHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4S/c1-5-12-8-13-14(18-16(17-4)19-15(13)21-12)20-7-6-10(2)11(3)9-20/h8,10-11H,5-7,9H2,1-4H3,(H,17,18,19).
What are the key properties of 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine?
4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 304.46 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethylpiperidin-1-yl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103330512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).