[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

C15H23N5S — CID 114596650

IUPAC[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCC1CC(C)C(C)N(Cc2nc(NN)c3ccsc3n2)C1
InChIInChI=1S/C15H23N5S/c1-9-6-10(2)11(3)20(7-9)8-13-17-14(19-16)12-4-5-21-15(12)18-13/h4-5,9-11H,6-8,16H2,1-3H3,(H,17,18,19)
InChIKeyVIMMWHJARKCSLO-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.84
Rot. Bonds3

About [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 114596650) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID114596650
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCC1CC(C)C(C)N(Cc2nc(NN)c3ccsc3n2)C1
InChIInChI=1S/C15H23N5S/c1-9-6-10(2)11(3)20(7-9)8-13-17-14(19-16)12-4-5-21-15(12)18-13/h4-5,9-11H,6-8,16H2,1-3H3,(H,17,18,19)
InChIKeyVIMMWHJARKCSLO-UHFFFAOYSA-N
XLogP2.84
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 114596650) is [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is CC1CC(C)C(C)N(Cc2nc(NN)c3ccsc3n2)C1.
What is the InChIKey of [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is VIMMWHJARKCSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-9-6-10(2)11(3)20(7-9)8-13-17-14(19-16)12-4-5-21-15(12)18-13/h4-5,9-11H,6-8,16H2,1-3H3,(H,17,18,19).
What are the key properties of [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 305.45 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,3,5-trimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 114596650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).