2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol

C10H16N2O — CID 130725388

IUPAC2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol
SMILESCC1CC(O)(c2ccnn2C)C1C
InChIInChI=1S/C10H16N2O/c1-7-6-10(13,8(7)2)9-4-5-11-12(9)3/h4-5,7-8,13H,6H2,1-3H3
InChIKeyFDEZUCONBVYBPB-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.28
Rot. Bonds1

About 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol

2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol (PubChem CID 130725388) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol
PubChem CID130725388
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol
SMILESCC1CC(O)(c2ccnn2C)C1C
InChIInChI=1S/C10H16N2O/c1-7-6-10(13,8(7)2)9-4-5-11-12(9)3/h4-5,7-8,13H,6H2,1-3H3
InChIKeyFDEZUCONBVYBPB-UHFFFAOYSA-N
XLogP1.28
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol?
The IUPAC name of 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol (CID 130725388) is 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol.
What is the SMILES notation for 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol?
The canonical SMILES for 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol is CC1CC(O)(c2ccnn2C)C1C.
What is the InChIKey of 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol?
The InChIKey is FDEZUCONBVYBPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7-6-10(13,8(7)2)9-4-5-11-12(9)3/h4-5,7-8,13H,6H2,1-3H3.
What are the key properties of 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol?
2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(2-methylpyrazol-3-yl)cyclobutan-1-ol is sourced from PubChem (CID 130725388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).