cyclobutyl(1H-pyrazol-4-yl)methanol

C8H12N2O — CID 130573129

IUPACcyclobutyl(1H-pyrazol-4-yl)methanol
SMILESOC(c1cn[nH]c1)C1CCC1
InChIInChI=1S/C8H12N2O/c11-8(6-2-1-3-6)7-4-9-10-5-7/h4-6,8,11H,1-3H2,(H,9,10)
InChIKeyTWTADLJBGAAAOG-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.24
Rot. Bonds2

About cyclobutyl(1H-pyrazol-4-yl)methanol

cyclobutyl(1H-pyrazol-4-yl)methanol (PubChem CID 130573129) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is cyclobutyl(1H-pyrazol-4-yl)methanol.

Molecular Properties

Compound Namecyclobutyl(1H-pyrazol-4-yl)methanol
PubChem CID130573129
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Namecyclobutyl(1H-pyrazol-4-yl)methanol
SMILESOC(c1cn[nH]c1)C1CCC1
InChIInChI=1S/C8H12N2O/c11-8(6-2-1-3-6)7-4-9-10-5-7/h4-6,8,11H,1-3H2,(H,9,10)
InChIKeyTWTADLJBGAAAOG-UHFFFAOYSA-N
XLogP1.24
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl(1H-pyrazol-4-yl)methanol?
The IUPAC name of cyclobutyl(1H-pyrazol-4-yl)methanol (CID 130573129) is cyclobutyl(1H-pyrazol-4-yl)methanol.
What is the SMILES notation for cyclobutyl(1H-pyrazol-4-yl)methanol?
The canonical SMILES for cyclobutyl(1H-pyrazol-4-yl)methanol is OC(c1cn[nH]c1)C1CCC1.
What is the InChIKey of cyclobutyl(1H-pyrazol-4-yl)methanol?
The InChIKey is TWTADLJBGAAAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c11-8(6-2-1-3-6)7-4-9-10-5-7/h4-6,8,11H,1-3H2,(H,9,10).
What are the key properties of cyclobutyl(1H-pyrazol-4-yl)methanol?
cyclobutyl(1H-pyrazol-4-yl)methanol has a molecular weight of 152.20 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl(1H-pyrazol-4-yl)methanol is sourced from PubChem (CID 130573129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).