1-pyrrolidin-3-ylpyrazol-4-ol

C7H11N3O — CID 82416886

IUPAC1-pyrrolidin-3-ylpyrazol-4-ol
SMILESOc1cnn(C2CCNC2)c1
InChIInChI=1S/C7H11N3O/c11-7-4-9-10(5-7)6-1-2-8-3-6/h4-6,8,11H,1-3H2
InChIKeyWMAFUMOUBQBYAK-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.12
Rot. Bonds1

About 1-pyrrolidin-3-ylpyrazol-4-ol

1-pyrrolidin-3-ylpyrazol-4-ol (PubChem CID 82416886) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-pyrrolidin-3-ylpyrazol-4-ol.

Molecular Properties

Compound Name1-pyrrolidin-3-ylpyrazol-4-ol
PubChem CID82416886
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1-pyrrolidin-3-ylpyrazol-4-ol
SMILESOc1cnn(C2CCNC2)c1
InChIInChI=1S/C7H11N3O/c11-7-4-9-10(5-7)6-1-2-8-3-6/h4-6,8,11H,1-3H2
InChIKeyWMAFUMOUBQBYAK-UHFFFAOYSA-N
XLogP0.12
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-3-ylpyrazol-4-ol?
The IUPAC name of 1-pyrrolidin-3-ylpyrazol-4-ol (CID 82416886) is 1-pyrrolidin-3-ylpyrazol-4-ol.
What is the SMILES notation for 1-pyrrolidin-3-ylpyrazol-4-ol?
The canonical SMILES for 1-pyrrolidin-3-ylpyrazol-4-ol is Oc1cnn(C2CCNC2)c1.
What is the InChIKey of 1-pyrrolidin-3-ylpyrazol-4-ol?
The InChIKey is WMAFUMOUBQBYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c11-7-4-9-10(5-7)6-1-2-8-3-6/h4-6,8,11H,1-3H2.
What are the key properties of 1-pyrrolidin-3-ylpyrazol-4-ol?
1-pyrrolidin-3-ylpyrazol-4-ol has a molecular weight of 153.19 g/mol, XLogP of 0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-3-ylpyrazol-4-ol is sourced from PubChem (CID 82416886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).