2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol

C4H8N4O2 — CID 69341697

IUPAC2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol
SMILESNc1nnc(NCCO)o1
InChIInChI=1S/C4H8N4O2/c5-3-7-8-4(10-3)6-1-2-9/h9H,1-2H2,(H2,5,7)(H,6,8)
InChIKeySDDWLQBDWWMOQW-UHFFFAOYSA-N
MW144.13 g/mol
LogP-0.94
Rot. Bonds3

About 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol

2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol (PubChem CID 69341697) has the molecular formula C4H8N4O2 and a molecular weight of 144.13 g/mol. Its IUPAC name is 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol
PubChem CID69341697
Molecular FormulaC4H8N4O2
Molecular Weight144.13 g/mol
Exact Mass144.06
IUPAC Name2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol
SMILESNc1nnc(NCCO)o1
InChIInChI=1S/C4H8N4O2/c5-3-7-8-4(10-3)6-1-2-9/h9H,1-2H2,(H2,5,7)(H,6,8)
InChIKeySDDWLQBDWWMOQW-UHFFFAOYSA-N
XLogP-0.94
TPSA97.20 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol?
The IUPAC name of 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol (CID 69341697) is 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol?
The canonical SMILES for 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol is Nc1nnc(NCCO)o1.
What is the InChIKey of 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol?
The InChIKey is SDDWLQBDWWMOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O2/c5-3-7-8-4(10-3)6-1-2-9/h9H,1-2H2,(H2,5,7)(H,6,8).
What are the key properties of 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol?
2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol has a molecular weight of 144.13 g/mol, XLogP of -0.94, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-1,3,4-oxadiazol-2-yl)amino]ethanol is sourced from PubChem (CID 69341697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).