1-(3-fluoropropyl)pyrazol-4-ol

C6H9FN2O — CID 116799422

IUPAC1-(3-fluoropropyl)pyrazol-4-ol
SMILESOc1cnn(CCCF)c1
InChIInChI=1S/C6H9FN2O/c7-2-1-3-9-5-6(10)4-8-9/h4-5,10H,1-3H2
InChIKeyGUFXHPNYMFXZNZ-UHFFFAOYSA-N
MW144.15 g/mol
LogP0.95
Rot. Bonds3

About 1-(3-fluoropropyl)pyrazol-4-ol

1-(3-fluoropropyl)pyrazol-4-ol (PubChem CID 116799422) has the molecular formula C6H9FN2O and a molecular weight of 144.15 g/mol. Its IUPAC name is 1-(3-fluoropropyl)pyrazol-4-ol.

Molecular Properties

Compound Name1-(3-fluoropropyl)pyrazol-4-ol
PubChem CID116799422
Molecular FormulaC6H9FN2O
Molecular Weight144.15 g/mol
Exact Mass144.07
IUPAC Name1-(3-fluoropropyl)pyrazol-4-ol
SMILESOc1cnn(CCCF)c1
InChIInChI=1S/C6H9FN2O/c7-2-1-3-9-5-6(10)4-8-9/h4-5,10H,1-3H2
InChIKeyGUFXHPNYMFXZNZ-UHFFFAOYSA-N
XLogP0.95
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.15
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluoropropyl)-4-iodopyrazole
CID 79020404
1-(4-methylpentyl)pyrazol-4-ol
CID 116799439
1-(aminomethyl)pyrazol-4-ol
CID 117125261
1-(3-ethylsulfanylpropyl)pyrazol-4-ol
CID 116799350
1-(2-methoxyethyl)pyrazol-4-ol
CID 75466201
1-[2-(trifluoromethylsulfanyl)ethyl]pyrazol-4-ol
CID 116799456
1-(3-fluoropropyl)pyrazole-4-sulfonyl chloride
CID 81113658
1-(2-piperazin-1-ylethyl)pyrazol-4-ol
CID 82399492
1-(2-phenylsulfanylethyl)pyrazol-4-ol
CID 116799458
1-(3-fluoropropyl)-4-(3-iodophenyl)pyrazole
CID 81110244
1-[2-(oxan-4-yl)ethyl]pyrazol-4-ol
CID 131218916
1-but-2-ynylpyrazol-4-ol
CID 122240485

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)pyrazol-4-ol?
The IUPAC name of 1-(3-fluoropropyl)pyrazol-4-ol (CID 116799422) is 1-(3-fluoropropyl)pyrazol-4-ol.
What is the SMILES notation for 1-(3-fluoropropyl)pyrazol-4-ol?
The canonical SMILES for 1-(3-fluoropropyl)pyrazol-4-ol is Oc1cnn(CCCF)c1.
What is the InChIKey of 1-(3-fluoropropyl)pyrazol-4-ol?
The InChIKey is GUFXHPNYMFXZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2O/c7-2-1-3-9-5-6(10)4-8-9/h4-5,10H,1-3H2.
What are the key properties of 1-(3-fluoropropyl)pyrazol-4-ol?
1-(3-fluoropropyl)pyrazol-4-ol has a molecular weight of 144.15 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)pyrazol-4-ol is sourced from PubChem (CID 116799422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).