1-(4-fluorophenyl)-2-methylpyrazolidine

C10H13FN2 — CID 59602837

IUPAC1-(4-fluorophenyl)-2-methylpyrazolidine
SMILESCN1CCCN1c1ccc(F)cc1
InChIInChI=1S/C10H13FN2/c1-12-7-2-8-13(12)10-5-3-9(11)4-6-10/h3-6H,2,7-8H2,1H3
InChIKeyUXBOXOIBQFHAJI-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.88
Rot. Bonds1

About 1-(4-fluorophenyl)-2-methylpyrazolidine

1-(4-fluorophenyl)-2-methylpyrazolidine (PubChem CID 59602837) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-methylpyrazolidine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-methylpyrazolidine
PubChem CID59602837
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name1-(4-fluorophenyl)-2-methylpyrazolidine
SMILESCN1CCCN1c1ccc(F)cc1
InChIInChI=1S/C10H13FN2/c1-12-7-2-8-13(12)10-5-3-9(11)4-6-10/h3-6H,2,7-8H2,1H3
InChIKeyUXBOXOIBQFHAJI-UHFFFAOYSA-N
XLogP1.88
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-2-methyldiazinane
CID 59602817
1-(2,4-difluorophenyl)-2-methylpyrazolidine
CID 59602822
1-(2,4-difluorophenyl)-2-methyldiazinane
CID 59602841
2-(4-fluorophenyl)-1-methyl-3H-1,2,4-triazole
CID 142798426
2-(4-fluorophenyl)-1,5-dimethyl-3H-pyrazole
CID 150439105
ethane;1-(4-fluorophenyl)-4-propan-2-ylpiperazine
CID 144656780
1-(4-fluorophenyl)-4,6-dimethyl-1,5-diazocane
CID 54973091
ethane;1-(4-fluorophenyl)-1,4-diazepane
CID 168950071
1,3-bis(4-fluorophenyl)-2-methyl-1,3,2λ5-diazaphospholidine 2-oxide
CID 159663029
4-(4-fluorophenyl)-1,1-dimethylpiperazin-1-ium
CID 10903809
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-propan-2-ylpropan-1-amine
CID 62425501
1-(4-fluorophenyl)-2-(4-methylsulfanylphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
CID 46256816

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-methylpyrazolidine?
The IUPAC name of 1-(4-fluorophenyl)-2-methylpyrazolidine (CID 59602837) is 1-(4-fluorophenyl)-2-methylpyrazolidine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-methylpyrazolidine?
The canonical SMILES for 1-(4-fluorophenyl)-2-methylpyrazolidine is CN1CCCN1c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-methylpyrazolidine?
The InChIKey is UXBOXOIBQFHAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c1-12-7-2-8-13(12)10-5-3-9(11)4-6-10/h3-6H,2,7-8H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-methylpyrazolidine?
1-(4-fluorophenyl)-2-methylpyrazolidine has a molecular weight of 180.23 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-methylpyrazolidine is sourced from PubChem (CID 59602837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).