5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole

C7H10FN3 — CID 139344016

IUPAC5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole
SMILESFc1[nH]ncc1C1CCNC1
InChIInChI=1S/C7H10FN3/c8-7-6(4-10-11-7)5-1-2-9-3-5/h4-5,9H,1-3H2,(H,10,11)
InChIKeyWODUQGHCGFTHDT-UHFFFAOYSA-N
MW155.18 g/mol
LogP0.63
Rot. Bonds1

About 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole

5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole (PubChem CID 139344016) has the molecular formula C7H10FN3 and a molecular weight of 155.18 g/mol. Its IUPAC name is 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole.

Molecular Properties

Compound Name5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole
PubChem CID139344016
Molecular FormulaC7H10FN3
Molecular Weight155.18 g/mol
Exact Mass155.09
IUPAC Name5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole
SMILESFc1[nH]ncc1C1CCNC1
InChIInChI=1S/C7H10FN3/c8-7-6(4-10-11-7)5-1-2-9-3-5/h4-5,9H,1-3H2,(H,10,11)
InChIKeyWODUQGHCGFTHDT-UHFFFAOYSA-N
XLogP0.63
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.18
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-fluoro-1H-pyrazol-5-yl)piperidine;dihydrochloride
CID 155970629
4-(4-cyclobutyl-1H-pyrazol-5-yl)piperidine
CID 115024346
4-pyrrolidin-3-yl-2H-triazole
CID 54238328
3-(4-fluoro-2,5-dimethylphenyl)pyrrolidine
CID 84772856
5-pyrrolidin-3-ylpyrimidine
CID 66996535
4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole
CID 96637487
5-pyrrolidin-3-yl-1H-indazole
CID 82405322
7-fluoro-3-pyrrolidin-3-ylimidazo[1,5-a]pyridine
CID 105457249
1,5-dimethyl-4-pyrrolidin-3-ylpyrazole
CID 79583940
3-(4-chloro-2-fluorophenyl)pyrrolidine;hydrochloride
CID 169498278
(3S)-3-(3-chloro-2-fluorophenyl)pyrrolidine
CID 131096637
3-fluoro-4-pyrrolidin-3-ylaniline
CID 22625736

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole?
The IUPAC name of 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole (CID 139344016) is 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole.
What is the SMILES notation for 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole?
The canonical SMILES for 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole is Fc1[nH]ncc1C1CCNC1.
What is the InChIKey of 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole?
The InChIKey is WODUQGHCGFTHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3/c8-7-6(4-10-11-7)5-1-2-9-3-5/h4-5,9H,1-3H2,(H,10,11).
What are the key properties of 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole?
5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole has a molecular weight of 155.18 g/mol, XLogP of 0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-pyrrolidin-3-yl-1H-pyrazole is sourced from PubChem (CID 139344016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).