1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol

C10H17N3O — CID 117124752

IUPAC1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol
SMILESCC(C)N1CCCC1n1cc(O)cn1
InChIInChI=1S/C10H17N3O/c1-8(2)12-5-3-4-10(12)13-7-9(14)6-11-13/h6-8,10,14H,3-5H2,1-2H3
InChIKeyNBTFBNYIRINNHP-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.59
Rot. Bonds2

About 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol

1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol (PubChem CID 117124752) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol.

Molecular Properties

Compound Name1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol
PubChem CID117124752
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol
SMILESCC(C)N1CCCC1n1cc(O)cn1
InChIInChI=1S/C10H17N3O/c1-8(2)12-5-3-4-10(12)13-7-9(14)6-11-13/h6-8,10,14H,3-5H2,1-2H3
InChIKeyNBTFBNYIRINNHP-UHFFFAOYSA-N
XLogP1.59
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol?
The IUPAC name of 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol (CID 117124752) is 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol.
What is the SMILES notation for 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol?
The canonical SMILES for 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol is CC(C)N1CCCC1n1cc(O)cn1.
What is the InChIKey of 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol?
The InChIKey is NBTFBNYIRINNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8(2)12-5-3-4-10(12)13-7-9(14)6-11-13/h6-8,10,14H,3-5H2,1-2H3.
What are the key properties of 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol?
1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol has a molecular weight of 195.27 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propan-2-ylpyrrolidin-2-yl)pyrazol-4-ol is sourced from PubChem (CID 117124752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).