1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol

C15H17N5O2 — CID 139331365

IUPAC1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol
SMILESCC(C)n1nc(-c2cc(C3(O)CC3)on2)c2c(N)nccc21
InChIInChI=1S/C15H17N5O2/c1-8(2)20-10-3-6-17-14(16)12(10)13(18-20)9-7-11(22-19-9)15(21)4-5-15/h3,6-8,21H,4-5H2,1-2H3,(H2,16,17)
InChIKeyMIAILGNSSOIULQ-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.23
Rot. Bonds3

About 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol

1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol (PubChem CID 139331365) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol
PubChem CID139331365
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol
SMILESCC(C)n1nc(-c2cc(C3(O)CC3)on2)c2c(N)nccc21
InChIInChI=1S/C15H17N5O2/c1-8(2)20-10-3-6-17-14(16)12(10)13(18-20)9-7-11(22-19-9)15(21)4-5-15/h3,6-8,21H,4-5H2,1-2H3,(H2,16,17)
InChIKeyMIAILGNSSOIULQ-UHFFFAOYSA-N
XLogP2.23
TPSA102.99 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol?
The IUPAC name of 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol (CID 139331365) is 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol.
What is the SMILES notation for 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol?
The canonical SMILES for 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol is CC(C)n1nc(-c2cc(C3(O)CC3)on2)c2c(N)nccc21.
What is the InChIKey of 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol?
The InChIKey is MIAILGNSSOIULQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-8(2)20-10-3-6-17-14(16)12(10)13(18-20)9-7-11(22-19-9)15(21)4-5-15/h3,6-8,21H,4-5H2,1-2H3,(H2,16,17).
What are the key properties of 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol?
1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol has a molecular weight of 299.33 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-amino-1-propan-2-ylpyrazolo[4,3-c]pyridin-3-yl)-1,2-oxazol-5-yl]cyclopropan-1-ol is sourced from PubChem (CID 139331365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).