6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine

C14H20N4S — CID 103323826

IUPAC6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(N3CCCCC3C)nc(N)nc2s1
InChIInChI=1S/C14H20N4S/c1-3-10-8-11-12(16-14(15)17-13(11)19-10)18-7-5-4-6-9(18)2/h8-9H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyZYAJMZNTHAWNDJ-UHFFFAOYSA-N
MW276.41 g/mol
LogP3.21
Rot. Bonds2

About 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine

6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103323826) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103323826
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCc1cc2c(N3CCCCC3C)nc(N)nc2s1
InChIInChI=1S/C14H20N4S/c1-3-10-8-11-12(16-14(15)17-13(11)19-10)18-7-5-4-6-9(18)2/h8-9H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyZYAJMZNTHAWNDJ-UHFFFAOYSA-N
XLogP3.21
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine (CID 103323826) is 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine is CCc1cc2c(N3CCCCC3C)nc(N)nc2s1.
What is the InChIKey of 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is ZYAJMZNTHAWNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-3-10-8-11-12(16-14(15)17-13(11)19-10)18-7-5-4-6-9(18)2/h8-9H,3-7H2,1-2H3,(H2,15,16,17).
What are the key properties of 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 276.41 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103323826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).