2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol

C8H12N6O2 — CID 62498952

IUPAC2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol
SMILESOCCOCCNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O2/c15-2-4-16-3-1-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10,15H,1-4H2
InChIKeyKFMURAYOJNEVFG-UHFFFAOYSA-N
MW224.22 g/mol
LogP-1.06
Rot. Bonds6

About 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol

2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol (PubChem CID 62498952) has the molecular formula C8H12N6O2 and a molecular weight of 224.22 g/mol. Its IUPAC name is 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol
PubChem CID62498952
Molecular FormulaC8H12N6O2
Molecular Weight224.22 g/mol
Exact Mass224.10
IUPAC Name2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol
SMILESOCCOCCNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O2/c15-2-4-16-3-1-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10,15H,1-4H2
InChIKeyKFMURAYOJNEVFG-UHFFFAOYSA-N
XLogP-1.06
TPSA97.46 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol (CID 62498952) is 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol is OCCOCCNc1cncc2nnnn12.
What is the InChIKey of 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol?
The InChIKey is KFMURAYOJNEVFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N6O2/c15-2-4-16-3-1-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10,15H,1-4H2.
What are the key properties of 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol?
2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol has a molecular weight of 224.22 g/mol, XLogP of -1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(tetrazolo[1,5-a]pyrazin-5-ylamino)ethoxy]ethanol is sourced from PubChem (CID 62498952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).