4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide

C12H14N4OS — CID 71654775

IUPAC4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2ncnc(N3CCCCC3)c2s1
InChIInChI=1S/C12H14N4OS/c13-11(17)9-6-8-10(18-9)12(15-7-14-8)16-4-2-1-3-5-16/h6-7H,1-5H2,(H2,13,17)
InChIKeyOGGAXCGKZTXIMR-UHFFFAOYSA-N
MW262.34 g/mol
LogP1.78
Rot. Bonds2

About 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide

4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide (PubChem CID 71654775) has the molecular formula C12H14N4OS and a molecular weight of 262.34 g/mol. Its IUPAC name is 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide
PubChem CID71654775
Molecular FormulaC12H14N4OS
Molecular Weight262.34 g/mol
Exact Mass262.09
IUPAC Name4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2ncnc(N3CCCCC3)c2s1
InChIInChI=1S/C12H14N4OS/c13-11(17)9-6-8-10(18-9)12(15-7-14-8)16-4-2-1-3-5-16/h6-7H,1-5H2,(H2,13,17)
InChIKeyOGGAXCGKZTXIMR-UHFFFAOYSA-N
XLogP1.78
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide?
The IUPAC name of 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide (CID 71654775) is 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide?
The canonical SMILES for 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide is NC(=O)c1cc2ncnc(N3CCCCC3)c2s1.
What is the InChIKey of 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide?
The InChIKey is OGGAXCGKZTXIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS/c13-11(17)9-6-8-10(18-9)12(15-7-14-8)16-4-2-1-3-5-16/h6-7H,1-5H2,(H2,13,17).
What are the key properties of 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide?
4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide has a molecular weight of 262.34 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-ylthieno[3,2-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 71654775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).