7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine

C12H15N3S — CID 2808064

IUPAC7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine
SMILESCc1csc2c(N3CCCCC3)ncnc12
InChIInChI=1S/C12H15N3S/c1-9-7-16-11-10(9)13-8-14-12(11)15-5-3-2-4-6-15/h7-8H,2-6H2,1H3
InChIKeyLXIDSKZPUDELPZ-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.99
Rot. Bonds1

About 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine

7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine (PubChem CID 2808064) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine
PubChem CID2808064
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine
SMILESCc1csc2c(N3CCCCC3)ncnc12
InChIInChI=1S/C12H15N3S/c1-9-7-16-11-10(9)13-8-14-12(11)15-5-3-2-4-6-15/h7-8H,2-6H2,1H3
InChIKeyLXIDSKZPUDELPZ-UHFFFAOYSA-N
XLogP2.99
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine?
The IUPAC name of 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine (CID 2808064) is 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine.
What is the SMILES notation for 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine?
The canonical SMILES for 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine is Cc1csc2c(N3CCCCC3)ncnc12.
What is the InChIKey of 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine?
The InChIKey is LXIDSKZPUDELPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c1-9-7-16-11-10(9)13-8-14-12(11)15-5-3-2-4-6-15/h7-8H,2-6H2,1H3.
What are the key properties of 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine?
7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine has a molecular weight of 233.34 g/mol, XLogP of 2.99, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-piperidin-1-ylthieno[3,2-d]pyrimidine is sourced from PubChem (CID 2808064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).