2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

C11H15N5OS — CID 103333014

IUPAC2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESNNc1nc(N(CCO)C2CC2)c2ccsc2n1
InChIInChI=1S/C11H15N5OS/c12-15-11-13-9(8-3-6-18-10(8)14-11)16(4-5-17)7-1-2-7/h3,6-7,17H,1-2,4-5,12H2,(H,13,14,15)
InChIKeyWKQNRDSVGYZLIO-UHFFFAOYSA-N
MW265.34 g/mol
LogP0.94
Rot. Bonds5

About 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (PubChem CID 103333014) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
PubChem CID103333014
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC Name2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESNNc1nc(N(CCO)C2CC2)c2ccsc2n1
InChIInChI=1S/C11H15N5OS/c12-15-11-13-9(8-3-6-18-10(8)14-11)16(4-5-17)7-1-2-7/h3,6-7,17H,1-2,4-5,12H2,(H,13,14,15)
InChIKeyWKQNRDSVGYZLIO-UHFFFAOYSA-N
XLogP0.94
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol 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 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (CID 103333014) is 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is NNc1nc(N(CCO)C2CC2)c2ccsc2n1.
What is the InChIKey of 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The InChIKey is WKQNRDSVGYZLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c12-15-11-13-9(8-3-6-18-10(8)14-11)16(4-5-17)7-1-2-7/h3,6-7,17H,1-2,4-5,12H2,(H,13,14,15).
What are the key properties of 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol has a molecular weight of 265.34 g/mol, XLogP of 0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 103333014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).