(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol

C7H9FN2O — CID 105430463

IUPAC(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol
SMILESOCc1n[nH]c2c1C(F)CC2
InChIInChI=1S/C7H9FN2O/c8-4-1-2-5-7(4)6(3-11)10-9-5/h4,11H,1-3H2,(H,9,10)
InChIKeyBRZXBYRATLDXQH-UHFFFAOYSA-N
MW156.16 g/mol
LogP0.86
Rot. Bonds1

About (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol

(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol (PubChem CID 105430463) has the molecular formula C7H9FN2O and a molecular weight of 156.16 g/mol. Its IUPAC name is (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol
PubChem CID105430463
Molecular FormulaC7H9FN2O
Molecular Weight156.16 g/mol
Exact Mass156.07
IUPAC Name(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol
SMILESOCc1n[nH]c2c1C(F)CC2
InChIInChI=1S/C7H9FN2O/c8-4-1-2-5-7(4)6(3-11)10-9-5/h4,11H,1-3H2,(H,9,10)
InChIKeyBRZXBYRATLDXQH-UHFFFAOYSA-N
XLogP0.86
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanol
CID 21787796
(5-Cyclopropyl-4-fluoro-1H-pyrazol-3-YL)methanol
CID 135266854
1-[4-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]ethanol
CID 135304000
[3-(2-fluoropropan-2-yl)-4-methyl-1H-pyrazol-5-yl]methanol
CID 163425053
(4S)-5-fluoro-5-methyl-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
CID 168250442
5,6-Difluoro-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-ol;1,2,3-trifluorocyclohexane
CID 168250475
5,6-Difluoro-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-ol
CID 168250476
2,2-difluorospiro[2.3]hexane;5,5-difluoro-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
CID 168250505
5,5-difluoro-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
CID 168250506
(S)-5,5-Difluoro-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-ol
CID 168250594
1,2-Difluorocyclohexane;5,6-difluoro-3-(trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-ol
CID 168250604
1,3-difluorocyclohexane;5,5-difluoro-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-ol
CID 168250656

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol?
The IUPAC name of (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol (CID 105430463) is (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol.
What is the SMILES notation for (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol?
The canonical SMILES for (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol is OCc1n[nH]c2c1C(F)CC2.
What is the InChIKey of (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol?
The InChIKey is BRZXBYRATLDXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O/c8-4-1-2-5-7(4)6(3-11)10-9-5/h4,11H,1-3H2,(H,9,10).
What are the key properties of (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol?
(4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol has a molecular weight of 156.16 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methanol is sourced from PubChem (CID 105430463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).