(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol

C8H11FN2O — CID 105434429

IUPAC(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol
SMILESCn1nc(CO)c2c1CCC2F
InChIInChI=1S/C8H11FN2O/c1-11-7-3-2-5(9)8(7)6(4-12)10-11/h5,12H,2-4H2,1H3
InChIKeyBWVFKGVGLJGFQT-UHFFFAOYSA-N
MW170.19 g/mol
LogP0.87
Rot. Bonds1

About (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol

(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol (PubChem CID 105434429) has the molecular formula C8H11FN2O and a molecular weight of 170.19 g/mol. Its IUPAC name is (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol
PubChem CID105434429
Molecular FormulaC8H11FN2O
Molecular Weight170.19 g/mol
Exact Mass170.09
IUPAC Name(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol
SMILESCn1nc(CO)c2c1CCC2F
InChIInChI=1S/C8H11FN2O/c1-11-7-3-2-5(9)8(7)6(4-12)10-11/h5,12H,2-4H2,1H3
InChIKeyBWVFKGVGLJGFQT-UHFFFAOYSA-N
XLogP0.87
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.19
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-Ethyl-5-fluoro-1-methylpyrazol-3-yl)methanol
CID 68381609
2-(4-Fluoro-1,5-dimethylpyrazol-3-yl)propan-2-ol
CID 89147283
3-(1,1-difluoroethyl)-1-propan-2-yl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 90162237
1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-6-ol
CID 90162782
1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 90162790
1-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 90167572
1-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-ol
CID 90167802
1-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-6-ol
CID 90167987
(5-Cyclopropyl-4-fluoro-2-methylpyrazol-3-yl)methanol
CID 118948990
1-ethyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-ol
CID 129129812
[3-(1,1-Difluoroethyl)-1,5-dimethylpyrazol-4-yl]methanol;ethane
CID 145222067
2-(difluoromethyl)-3-propan-2-yl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 146330882

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol?
The IUPAC name of (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol (CID 105434429) is (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol.
What is the SMILES notation for (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol?
The canonical SMILES for (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol is Cn1nc(CO)c2c1CCC2F.
What is the InChIKey of (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol?
The InChIKey is BWVFKGVGLJGFQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O/c1-11-7-3-2-5(9)8(7)6(4-12)10-11/h5,12H,2-4H2,1H3.
What are the key properties of (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol?
(4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol has a molecular weight of 170.19 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanol is sourced from PubChem (CID 105434429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).