1-(3-aminopyrazol-1-yl)propan-2-ol

C6H11N3O — CID 55284669

IUPAC1-(3-aminopyrazol-1-yl)propan-2-ol
SMILESCC(O)Cn1ccc(N)n1
InChIInChI=1S/C6H11N3O/c1-5(10)4-9-3-2-6(7)8-9/h2-3,5,10H,4H2,1H3,(H2,7,8)
InChIKeyQJCMYUTUCCCBMY-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.15
Rot. Bonds2

About 1-(3-aminopyrazol-1-yl)propan-2-ol

1-(3-aminopyrazol-1-yl)propan-2-ol (PubChem CID 55284669) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 1-(3-aminopyrazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-aminopyrazol-1-yl)propan-2-ol
PubChem CID55284669
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name1-(3-aminopyrazol-1-yl)propan-2-ol
SMILESCC(O)Cn1ccc(N)n1
InChIInChI=1S/C6H11N3O/c1-5(10)4-9-3-2-6(7)8-9/h2-3,5,10H,4H2,1H3,(H2,7,8)
InChIKeyQJCMYUTUCCCBMY-UHFFFAOYSA-N
XLogP-0.15
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopyrazol-1-yl)propan-2-ol?
The IUPAC name of 1-(3-aminopyrazol-1-yl)propan-2-ol (CID 55284669) is 1-(3-aminopyrazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(3-aminopyrazol-1-yl)propan-2-ol?
The canonical SMILES for 1-(3-aminopyrazol-1-yl)propan-2-ol is CC(O)Cn1ccc(N)n1.
What is the InChIKey of 1-(3-aminopyrazol-1-yl)propan-2-ol?
The InChIKey is QJCMYUTUCCCBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-5(10)4-9-3-2-6(7)8-9/h2-3,5,10H,4H2,1H3,(H2,7,8).
What are the key properties of 1-(3-aminopyrazol-1-yl)propan-2-ol?
1-(3-aminopyrazol-1-yl)propan-2-ol has a molecular weight of 141.17 g/mol, XLogP of -0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopyrazol-1-yl)propan-2-ol is sourced from PubChem (CID 55284669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).