3-pyrazol-1-ylcyclobutan-1-ol

C7H10N2O — CID 130861369

IUPAC3-pyrazol-1-ylcyclobutan-1-ol
SMILESOC1CC(n2cccn2)C1
InChIInChI=1S/C7H10N2O/c10-7-4-6(5-7)9-3-1-2-8-9/h1-3,6-7,10H,4-5H2
InChIKeyLDMHOTLSUTVSPN-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.58
Rot. Bonds1

About 3-pyrazol-1-ylcyclobutan-1-ol

3-pyrazol-1-ylcyclobutan-1-ol (PubChem CID 130861369) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-pyrazol-1-ylcyclobutan-1-ol.

Molecular Properties

Compound Name3-pyrazol-1-ylcyclobutan-1-ol
PubChem CID130861369
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-pyrazol-1-ylcyclobutan-1-ol
SMILESOC1CC(n2cccn2)C1
InChIInChI=1S/C7H10N2O/c10-7-4-6(5-7)9-3-1-2-8-9/h1-3,6-7,10H,4-5H2
InChIKeyLDMHOTLSUTVSPN-UHFFFAOYSA-N
XLogP0.58
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyrazol-1-ylcyclobutan-1-ol?
The IUPAC name of 3-pyrazol-1-ylcyclobutan-1-ol (CID 130861369) is 3-pyrazol-1-ylcyclobutan-1-ol.
What is the SMILES notation for 3-pyrazol-1-ylcyclobutan-1-ol?
The canonical SMILES for 3-pyrazol-1-ylcyclobutan-1-ol is OC1CC(n2cccn2)C1.
What is the InChIKey of 3-pyrazol-1-ylcyclobutan-1-ol?
The InChIKey is LDMHOTLSUTVSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c10-7-4-6(5-7)9-3-1-2-8-9/h1-3,6-7,10H,4-5H2.
What are the key properties of 3-pyrazol-1-ylcyclobutan-1-ol?
3-pyrazol-1-ylcyclobutan-1-ol has a molecular weight of 138.17 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazol-1-ylcyclobutan-1-ol is sourced from PubChem (CID 130861369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).