N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine

C13H19N5S — CID 70537757

IUPACN,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1csc2nc(N3CCNCC3)nc(N(C)C)c12
InChIInChI=1S/C13H19N5S/c1-9-8-19-12-10(9)11(17(2)3)15-13(16-12)18-6-4-14-5-7-18/h8,14H,4-7H2,1-3H3
InChIKeyBNFHPFSLSLVFCK-UHFFFAOYSA-N
MW277.40 g/mol
LogP1.48
Rot. Bonds2

About N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine

N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 70537757) has the molecular formula C13H19N5S and a molecular weight of 277.40 g/mol. Its IUPAC name is N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID70537757
Molecular FormulaC13H19N5S
Molecular Weight277.40 g/mol
Exact Mass277.14
IUPAC NameN,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1csc2nc(N3CCNCC3)nc(N(C)C)c12
InChIInChI=1S/C13H19N5S/c1-9-8-19-12-10(9)11(17(2)3)15-13(16-12)18-6-4-14-5-7-18/h8,14H,4-7H2,1-3H3
InChIKeyBNFHPFSLSLVFCK-UHFFFAOYSA-N
XLogP1.48
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.40
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine (CID 70537757) is N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine is Cc1csc2nc(N3CCNCC3)nc(N(C)C)c12.
What is the InChIKey of N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is BNFHPFSLSLVFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5S/c1-9-8-19-12-10(9)11(17(2)3)15-13(16-12)18-6-4-14-5-7-18/h8,14H,4-7H2,1-3H3.
What are the key properties of N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 277.40 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-trimethyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 70537757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).