2-pyrazol-1-yl-1,3-oxazol-5-amine

C6H6N4O — CID 96636215

IUPAC2-pyrazol-1-yl-1,3-oxazol-5-amine
SMILESNc1cnc(-n2cccn2)o1
InChIInChI=1S/C6H6N4O/c7-5-4-8-6(11-5)10-3-1-2-9-10/h1-4H,7H2
InChIKeyDHWFGWDEZPOZMA-UHFFFAOYSA-N
MW150.14 g/mol
LogP0.44
Rot. Bonds1

About 2-pyrazol-1-yl-1,3-oxazol-5-amine

2-pyrazol-1-yl-1,3-oxazol-5-amine (PubChem CID 96636215) has the molecular formula C6H6N4O and a molecular weight of 150.14 g/mol. Its IUPAC name is 2-pyrazol-1-yl-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-pyrazol-1-yl-1,3-oxazol-5-amine
PubChem CID96636215
Molecular FormulaC6H6N4O
Molecular Weight150.14 g/mol
Exact Mass150.05
IUPAC Name2-pyrazol-1-yl-1,3-oxazol-5-amine
SMILESNc1cnc(-n2cccn2)o1
InChIInChI=1S/C6H6N4O/c7-5-4-8-6(11-5)10-3-1-2-9-10/h1-4H,7H2
InChIKeyDHWFGWDEZPOZMA-UHFFFAOYSA-N
XLogP0.44
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-pyrazol-1-yl-1,3-oxazol-5-amine?
The IUPAC name of 2-pyrazol-1-yl-1,3-oxazol-5-amine (CID 96636215) is 2-pyrazol-1-yl-1,3-oxazol-5-amine.
What is the SMILES notation for 2-pyrazol-1-yl-1,3-oxazol-5-amine?
The canonical SMILES for 2-pyrazol-1-yl-1,3-oxazol-5-amine is Nc1cnc(-n2cccn2)o1.
What is the InChIKey of 2-pyrazol-1-yl-1,3-oxazol-5-amine?
The InChIKey is DHWFGWDEZPOZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O/c7-5-4-8-6(11-5)10-3-1-2-9-10/h1-4H,7H2.
What are the key properties of 2-pyrazol-1-yl-1,3-oxazol-5-amine?
2-pyrazol-1-yl-1,3-oxazol-5-amine has a molecular weight of 150.14 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-1,3-oxazol-5-amine is sourced from PubChem (CID 96636215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).