3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid

C11H10N4O4 — CID 64527274

IUPAC3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
SMILESO=C(Nc1cc(C(=O)O)[nH]n1)c1cc(C2CC2)on1
InChIInChI=1S/C11H10N4O4/c16-10(6-3-8(19-15-6)5-1-2-5)12-9-4-7(11(17)18)13-14-9/h3-5H,1-2H2,(H,17,18)(H2,12,13,14,16)
InChIKeyFIBQJQJEXKCAMN-UHFFFAOYSA-N
MW262.23 g/mol
LogP1.23
Rot. Bonds4

About 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid

3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid (PubChem CID 64527274) has the molecular formula C11H10N4O4 and a molecular weight of 262.23 g/mol. Its IUPAC name is 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid.

Molecular Properties

Compound Name3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
PubChem CID64527274
Molecular FormulaC11H10N4O4
Molecular Weight262.23 g/mol
Exact Mass262.07
IUPAC Name3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
SMILESO=C(Nc1cc(C(=O)O)[nH]n1)c1cc(C2CC2)on1
InChIInChI=1S/C11H10N4O4/c16-10(6-3-8(19-15-6)5-1-2-5)12-9-4-7(11(17)18)13-14-9/h3-5H,1-2H2,(H,17,18)(H2,12,13,14,16)
InChIKeyFIBQJQJEXKCAMN-UHFFFAOYSA-N
XLogP1.23
TPSA121.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid?
The IUPAC name of 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid (CID 64527274) is 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid.
What is the SMILES notation for 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid?
The canonical SMILES for 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid is O=C(Nc1cc(C(=O)O)[nH]n1)c1cc(C2CC2)on1.
What is the InChIKey of 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid?
The InChIKey is FIBQJQJEXKCAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O4/c16-10(6-3-8(19-15-6)5-1-2-5)12-9-4-7(11(17)18)13-14-9/h3-5H,1-2H2,(H,17,18)(H2,12,13,14,16).
What are the key properties of 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid?
3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid has a molecular weight of 262.23 g/mol, XLogP of 1.23, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid is sourced from PubChem (CID 64527274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).