1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol

C13H14N2O — CID 107329942

IUPAC1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol
SMILESOC1(c2ccnn2-c2ccccc2)CCC1
InChIInChI=1S/C13H14N2O/c16-13(8-4-9-13)12-7-10-14-15(12)11-5-2-1-3-6-11/h1-3,5-7,10,16H,4,8-9H2
InChIKeyIROIMWNNCLJDNX-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.24
Rot. Bonds2

About 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol

1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol (PubChem CID 107329942) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol
PubChem CID107329942
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol
SMILESOC1(c2ccnn2-c2ccccc2)CCC1
InChIInChI=1S/C13H14N2O/c16-13(8-4-9-13)12-7-10-14-15(12)11-5-2-1-3-6-11/h1-3,5-7,10,16H,4,8-9H2
InChIKeyIROIMWNNCLJDNX-UHFFFAOYSA-N
XLogP2.24
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(2-phenylpyrazol-3-yl)piperidin-4-ol
CID 107329806
4-(methylamino)-1-(2-phenylpyrazol-3-yl)cyclohexan-1-ol
CID 107331436
2-methyl-3-(2-phenylpyrazol-3-yl)oxolan-3-ol
CID 107329996
1-(3-phenyltriazol-4-yl)cycloheptan-1-ol
CID 114684542
1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol
CID 107330437
2-methyl-2-(2-phenylpyrazol-3-yl)azepane
CID 107330736
1-phenyl-5-(2-propylpyrrolidin-2-yl)pyrazole
CID 107330715
4-(3-phenyltriazol-4-yl)azepan-4-ol
CID 114685429
[1-(dimethylamino)cyclopentyl]-(2-phenylpyrazol-3-yl)methanone
CID 107330172
N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-(2-phenylpyrazol-3-yl)methanamine
CID 131910912
(1-methoxycyclopentyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330230
(2-phenylpyrazol-3-yl)boronic acid
CID 59436217

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol?
The IUPAC name of 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol (CID 107329942) is 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol.
What is the SMILES notation for 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol?
The canonical SMILES for 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol is OC1(c2ccnn2-c2ccccc2)CCC1.
What is the InChIKey of 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol?
The InChIKey is IROIMWNNCLJDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c16-13(8-4-9-13)12-7-10-14-15(12)11-5-2-1-3-6-11/h1-3,5-7,10,16H,4,8-9H2.
What are the key properties of 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol?
1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol has a molecular weight of 214.27 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol is sourced from PubChem (CID 107329942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).