5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine

C15H14N4O — CID 117419702

IUPAC5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine
SMILESNc1cc(-c2cccc(-n3nccc3C3CC3)c2)on1
InChIInChI=1S/C15H14N4O/c16-15-9-14(20-18-15)11-2-1-3-12(8-11)19-13(6-7-17-19)10-4-5-10/h1-3,6-10H,4-5H2,(H2,16,18)
InChIKeyLYRSHQPKXROPGT-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.99
Rot. Bonds3

About 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine

5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine (PubChem CID 117419702) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine
PubChem CID117419702
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine
SMILESNc1cc(-c2cccc(-n3nccc3C3CC3)c2)on1
InChIInChI=1S/C15H14N4O/c16-15-9-14(20-18-15)11-2-1-3-12(8-11)19-13(6-7-17-19)10-4-5-10/h1-3,6-10H,4-5H2,(H2,16,18)
InChIKeyLYRSHQPKXROPGT-UHFFFAOYSA-N
XLogP2.99
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(triazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326394
2-[3-(5-cyclopropylpyrazol-1-yl)phenyl]ethanamine
CID 84691343
5-cyclopropyl-1-phenylpyrazole
CID 67206706
5-[3-(4,5-dihydroimidazol-1-yl)phenyl]-1,2-oxazol-3-amine
CID 117328747
2-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-5-(difluoromethyl)-1,3,4-oxadiazole
CID 162511065
5-(3-piperidin-4-ylphenyl)-1,2-oxazol-3-amine
CID 117360352
1-[3-(5-cyclopropylpyrazol-1-yl)phenyl]propan-2-one
CID 117353584
[5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1-methylpyrrolidin-3-yl]methanamine
CID 117477778
5-cyclopropyl-1-[3-(pyrrolidin-2-ylmethyl)phenyl]pyrazole
CID 117422199
2-[3-(5-cyclopropylpyrazol-1-yl)phenyl]propan-1-ol
CID 117358013
3-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-2,2-dimethylpropanoic acid
CID 117457932
5-[3-chloro-4-(oxan-4-yl)phenyl]-1,2-oxazol-3-amine
CID 117447033

Frequently Asked Questions

What is the IUPAC name of 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine?
The IUPAC name of 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine (CID 117419702) is 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine.
What is the SMILES notation for 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine?
The canonical SMILES for 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine is Nc1cc(-c2cccc(-n3nccc3C3CC3)c2)on1.
What is the InChIKey of 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine?
The InChIKey is LYRSHQPKXROPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-15-9-14(20-18-15)11-2-1-3-12(8-11)19-13(6-7-17-19)10-4-5-10/h1-3,6-10H,4-5H2,(H2,16,18).
What are the key properties of 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine?
5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine has a molecular weight of 266.30 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(5-cyclopropylpyrazol-1-yl)phenyl]-1,2-oxazol-3-amine is sourced from PubChem (CID 117419702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).