5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole

C10H15FN2 — CID 154340469

IUPAC5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole
SMILESCC(C)Cn1ncc(F)c1C1CC1
InChIInChI=1S/C10H15FN2/c1-7(2)6-13-10(8-3-4-8)9(11)5-12-13/h5,7-8H,3-4,6H2,1-2H3
InChIKeyCBCHPBCKAZUMEJ-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.56
Rot. Bonds3

About 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole

5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole (PubChem CID 154340469) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole.

Molecular Properties

Compound Name5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole
PubChem CID154340469
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC Name5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole
SMILESCC(C)Cn1ncc(F)c1C1CC1
InChIInChI=1S/C10H15FN2/c1-7(2)6-13-10(8-3-4-8)9(11)5-12-13/h5,7-8H,3-4,6H2,1-2H3
InChIKeyCBCHPBCKAZUMEJ-UHFFFAOYSA-N
XLogP2.56
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole?
The IUPAC name of 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole (CID 154340469) is 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole.
What is the SMILES notation for 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole?
The canonical SMILES for 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole is CC(C)Cn1ncc(F)c1C1CC1.
What is the InChIKey of 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole?
The InChIKey is CBCHPBCKAZUMEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-7(2)6-13-10(8-3-4-8)9(11)5-12-13/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole?
5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole has a molecular weight of 182.24 g/mol, XLogP of 2.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-4-fluoro-1-(2-methylpropyl)pyrazole is sourced from PubChem (CID 154340469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).