1-methyl-2-phenylpyrazolidin-4-ol

C10H14N2O — CID 130123869

IUPAC1-methyl-2-phenylpyrazolidin-4-ol
SMILESCN1CC(O)CN1c1ccccc1
InChIInChI=1S/C10H14N2O/c1-11-7-10(13)8-12(11)9-5-3-2-4-6-9/h2-6,10,13H,7-8H2,1H3
InChIKeyATWOPPXIPVVWQV-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.71
Rot. Bonds1

About 1-methyl-2-phenylpyrazolidin-4-ol

1-methyl-2-phenylpyrazolidin-4-ol (PubChem CID 130123869) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-methyl-2-phenylpyrazolidin-4-ol.

Molecular Properties

Compound Name1-methyl-2-phenylpyrazolidin-4-ol
PubChem CID130123869
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name1-methyl-2-phenylpyrazolidin-4-ol
SMILESCN1CC(O)CN1c1ccccc1
InChIInChI=1S/C10H14N2O/c1-11-7-10(13)8-12(11)9-5-3-2-4-6-9/h2-6,10,13H,7-8H2,1H3
InChIKeyATWOPPXIPVVWQV-UHFFFAOYSA-N
XLogP0.71
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethyl-1-phenylpyrazolidin-3-one
CID 19777787
1-phenylpyrrolidin-3-ol
CID 11171152
1-(benzenesulfinyl)azetidin-3-ol
CID 131137863
1-phenyl-5-propan-2-ylpyrrolidin-3-ol
CID 154695322
2-phenyl-5-propan-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 72615288
1,2-dibenzylpyrazolidin-4-ol
CID 12543345
1-phenylpiperidin-4-ol;dihydrochloride
CID 174840165
3-methyl-8-phenyl-3,8-diazabicyclo[3.2.1]octane
CID 170205699
2-methyl-1-phenyl-5H-tetrazole
CID 174331728
(2S,3R,4R,5S)-2,5-dimethyl-1-phenylpyrrolidine-3,4-diol
CID 59616949
1-(2-phenylpropyl)azetidin-3-ol
CID 121200321
1-(4-phenylbutyl)azetidin-3-ol
CID 114334514

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-phenylpyrazolidin-4-ol?
The IUPAC name of 1-methyl-2-phenylpyrazolidin-4-ol (CID 130123869) is 1-methyl-2-phenylpyrazolidin-4-ol.
What is the SMILES notation for 1-methyl-2-phenylpyrazolidin-4-ol?
The canonical SMILES for 1-methyl-2-phenylpyrazolidin-4-ol is CN1CC(O)CN1c1ccccc1.
What is the InChIKey of 1-methyl-2-phenylpyrazolidin-4-ol?
The InChIKey is ATWOPPXIPVVWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-11-7-10(13)8-12(11)9-5-3-2-4-6-9/h2-6,10,13H,7-8H2,1H3.
What are the key properties of 1-methyl-2-phenylpyrazolidin-4-ol?
1-methyl-2-phenylpyrazolidin-4-ol has a molecular weight of 178.24 g/mol, XLogP of 0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-phenylpyrazolidin-4-ol is sourced from PubChem (CID 130123869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).