2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

C10H15N5OS — CID 103335072

IUPAC2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESCCc1cc2c(NCCO)nc(NN)nc2s1
InChIInChI=1S/C10H15N5OS/c1-2-6-5-7-8(12-3-4-16)13-10(15-11)14-9(7)17-6/h5,16H,2-4,11H2,1H3,(H2,12,13,14,15)
InChIKeyXFWQPFYJAREQSQ-UHFFFAOYSA-N
MW253.33 g/mol
LogP0.94
Rot. Bonds5

About 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (PubChem CID 103335072) has the molecular formula C10H15N5OS and a molecular weight of 253.33 g/mol. Its IUPAC name is 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
PubChem CID103335072
Molecular FormulaC10H15N5OS
Molecular Weight253.33 g/mol
Exact Mass253.10
IUPAC Name2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESCCc1cc2c(NCCO)nc(NN)nc2s1
InChIInChI=1S/C10H15N5OS/c1-2-6-5-7-8(12-3-4-16)13-10(15-11)14-9(7)17-6/h5,16H,2-4,11H2,1H3,(H2,12,13,14,15)
InChIKeyXFWQPFYJAREQSQ-UHFFFAOYSA-N
XLogP0.94
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 50.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (CID 103335072) is 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is CCc1cc2c(NCCO)nc(NN)nc2s1.
What is the InChIKey of 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The InChIKey is XFWQPFYJAREQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5OS/c1-2-6-5-7-8(12-3-4-16)13-10(15-11)14-9(7)17-6/h5,16H,2-4,11H2,1H3,(H2,12,13,14,15).
What are the key properties of 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol has a molecular weight of 253.33 g/mol, XLogP of 0.94, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 103335072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).