5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide

C13H17N5O2 — CID 135242318

IUPAC5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1nc(-c2cc(C3CC3)on2)c(C(N)=O)c1N
InChIInChI=1S/C13H17N5O2/c1-6(2)18-12(14)10(13(15)19)11(16-18)8-5-9(20-17-8)7-3-4-7/h5-7H,3-4,14H2,1-2H3,(H2,15,19)
InChIKeyCWBLCWNHXXXENY-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.68
Rot. Bonds4

About 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide

5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 135242318) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID135242318
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)n1nc(-c2cc(C3CC3)on2)c(C(N)=O)c1N
InChIInChI=1S/C13H17N5O2/c1-6(2)18-12(14)10(13(15)19)11(16-18)8-5-9(20-17-8)7-3-4-7/h5-7H,3-4,14H2,1-2H3,(H2,15,19)
InChIKeyCWBLCWNHXXXENY-UHFFFAOYSA-N
XLogP1.68
TPSA112.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide (CID 135242318) is 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide is CC(C)n1nc(-c2cc(C3CC3)on2)c(C(N)=O)c1N.
What is the InChIKey of 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is CWBLCWNHXXXENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-6(2)18-12(14)10(13(15)19)11(16-18)8-5-9(20-17-8)7-3-4-7/h5-7H,3-4,14H2,1-2H3,(H2,15,19).
What are the key properties of 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide?
5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 275.31 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 135242318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).