[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

C15H15N5S — CID 62244233

IUPAC[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(CN2CCc3ccccc32)nc2sccc12
InChIInChI=1S/C15H15N5S/c16-19-14-11-6-8-21-15(11)18-13(17-14)9-20-7-5-10-3-1-2-4-12(10)20/h1-4,6,8H,5,7,9,16H2,(H,17,18,19)
InChIKeyMEQLRRVILXMAMZ-UHFFFAOYSA-N
MW297.39 g/mol
LogP2.54
Rot. Bonds3

About [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 62244233) has the molecular formula C15H15N5S and a molecular weight of 297.39 g/mol. Its IUPAC name is [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID62244233
Molecular FormulaC15H15N5S
Molecular Weight297.39 g/mol
Exact Mass297.10
IUPAC Name[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(CN2CCc3ccccc32)nc2sccc12
InChIInChI=1S/C15H15N5S/c16-19-14-11-6-8-21-15(11)18-13(17-14)9-20-7-5-10-3-1-2-4-12(10)20/h1-4,6,8H,5,7,9,16H2,(H,17,18,19)
InChIKeyMEQLRRVILXMAMZ-UHFFFAOYSA-N
XLogP2.54
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.39
LogP ≤ 52.54
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-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 62244233) is [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is NNc1nc(CN2CCc3ccccc32)nc2sccc12.
What is the InChIKey of [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is MEQLRRVILXMAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5S/c16-19-14-11-6-8-21-15(11)18-13(17-14)9-20-7-5-10-3-1-2-4-12(10)20/h1-4,6,8H,5,7,9,16H2,(H,17,18,19).
What are the key properties of [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 297.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-dihydroindol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62244233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).