2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol

C10H8N6O2 — CID 137013323

IUPAC2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol
SMILESNc1c(O)cccc1Oc1cncc2nnnn12
InChIInChI=1S/C10H8N6O2/c11-10-6(17)2-1-3-7(10)18-9-5-12-4-8-13-14-15-16(8)9/h1-5,17H,11H2
InChIKeyDIMWCLNXXOPQBB-UHFFFAOYSA-N
MW244.21 g/mol
LogP0.60
Rot. Bonds2

About 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol

2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol (PubChem CID 137013323) has the molecular formula C10H8N6O2 and a molecular weight of 244.21 g/mol. Its IUPAC name is 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol.

Molecular Properties

Compound Name2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol
PubChem CID137013323
Molecular FormulaC10H8N6O2
Molecular Weight244.21 g/mol
Exact Mass244.07
IUPAC Name2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol
SMILESNc1c(O)cccc1Oc1cncc2nnnn12
InChIInChI=1S/C10H8N6O2/c11-10-6(17)2-1-3-7(10)18-9-5-12-4-8-13-14-15-16(8)9/h1-5,17H,11H2
InChIKeyDIMWCLNXXOPQBB-UHFFFAOYSA-N
XLogP0.60
TPSA111.45 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

[2-chloro-6-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenyl]methanamine
CID 114323862
4,5-dichloro-2-(tetrazolo[1,5-a]pyrazin-5-yloxy)aniline
CID 107501213
5-(tetrazolo[1,5-a]pyrazin-5-yloxy)quinolin-8-amine
CID 116525650
5-fluoro-2-methyl-4-(tetrazolo[1,5-a]pyrazin-5-yloxy)aniline
CID 114417709
5-(4-bromo-3-methylphenoxy)tetrazolo[1,5-a]pyrazine
CID 83140613
2-amino-3-aminooxyphenol;dihydrochloride
CID 19876209
2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol
CID 114764591
[3-[(tetrazolo[1,5-a]pyrazin-5-ylamino)methyl]phenyl]methanol
CID 63311511
5-(2-amino-3-hydroxyphenoxy)pyrazine-2-carbonitrile
CID 137013341
2-amino-3-[(5-bromo-3-fluoro-2-pyridinyl)oxy]phenol
CID 114047343
1-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-yl)ethanamine
CID 63196327
ethyl 6-(2-amino-3-hydroxyphenoxy)pyridine-3-carboxylate
CID 114764586

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol?
The IUPAC name of 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol (CID 137013323) is 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol.
What is the SMILES notation for 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol?
The canonical SMILES for 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol is Nc1c(O)cccc1Oc1cncc2nnnn12.
What is the InChIKey of 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol?
The InChIKey is DIMWCLNXXOPQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6O2/c11-10-6(17)2-1-3-7(10)18-9-5-12-4-8-13-14-15-16(8)9/h1-5,17H,11H2.
What are the key properties of 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol?
2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol has a molecular weight of 244.21 g/mol, XLogP of 0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(tetrazolo[1,5-a]pyrazin-5-yloxy)phenol is sourced from PubChem (CID 137013323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).