2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol

C8H13FN2O — CID 84731982

IUPAC2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol
SMILESCC(C)(F)c1cnn(CCO)c1
InChIInChI=1S/C8H13FN2O/c1-8(2,9)7-5-10-11(6-7)3-4-12/h5-6,12H,3-4H2,1-2H3
InChIKeyPOVOHHIQNIHMOV-UHFFFAOYSA-N
MW172.20 g/mol
LogP1.08
Rot. Bonds3

About 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol

2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol (PubChem CID 84731982) has the molecular formula C8H13FN2O and a molecular weight of 172.20 g/mol. Its IUPAC name is 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol
PubChem CID84731982
Molecular FormulaC8H13FN2O
Molecular Weight172.20 g/mol
Exact Mass172.10
IUPAC Name2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol
SMILESCC(C)(F)c1cnn(CCO)c1
InChIInChI=1S/C8H13FN2O/c1-8(2,9)7-5-10-11(6-7)3-4-12/h5-6,12H,3-4H2,1-2H3
InChIKeyPOVOHHIQNIHMOV-UHFFFAOYSA-N
XLogP1.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.20
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol
CID 62596877
2-(1-Methyl-1H-pyrazol-4-yl)ethanol
CID 17028076
1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol
CID 21825961
1-[1-(2-methoxyethyl)-1H-pyrazol-4-yl]ethan-1-amine
CID 62729330
2-(4-Methyl-1H-pyrazol-1-yl)propan-1-ol
CID 45791165
2-(4-ethyl-1H-pyrazol-1-yl)acetic acid
CID 68081749
2,2,2-trifluoro-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol
CID 54593112
(1R)-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol
CID 33821152
2-(4-Methyl-1H-pyrazol-1-yl)ethanol hydrochloride
CID 53433651
2-(4,5-Dimethylpyrazol-1-yl)ethanol
CID 58514590
2-(4-Methyl-1H-pyrazol-1-YL)ethanol
CID 19621864
2-(4-(Aminomethyl)-1H-pyrazol-1-YL)ethanol
CID 24708562

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol (CID 84731982) is 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol is CC(C)(F)c1cnn(CCO)c1.
What is the InChIKey of 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol?
The InChIKey is POVOHHIQNIHMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FN2O/c1-8(2,9)7-5-10-11(6-7)3-4-12/h5-6,12H,3-4H2,1-2H3.
What are the key properties of 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol?
2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol has a molecular weight of 172.20 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluoropropan-2-yl)pyrazol-1-yl]ethanol is sourced from PubChem (CID 84731982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).