2-(2,3,5-trifluorophenyl)pyrrolidine

C10H10F3N — CID 77131470

IUPAC2-(2,3,5-trifluorophenyl)pyrrolidine
SMILESFc1cc(F)c(F)c(C2CCCN2)c1
InChIInChI=1S/C10H10F3N/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h4-5,9,14H,1-3H2
InChIKeyJPHZSASVRMNOMF-UHFFFAOYSA-N
MW201.19 g/mol
LogP2.53
Rot. Bonds1

About 2-(2,3,5-trifluorophenyl)pyrrolidine

2-(2,3,5-trifluorophenyl)pyrrolidine (PubChem CID 77131470) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is 2-(2,3,5-trifluorophenyl)pyrrolidine.

Molecular Properties

Compound Name2-(2,3,5-trifluorophenyl)pyrrolidine
PubChem CID77131470
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name2-(2,3,5-trifluorophenyl)pyrrolidine
SMILESFc1cc(F)c(F)c(C2CCCN2)c1
InChIInChI=1S/C10H10F3N/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h4-5,9,14H,1-3H2
InChIKeyJPHZSASVRMNOMF-UHFFFAOYSA-N
XLogP2.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(2,3,5-trifluorophenyl)pyrrolidine;hydrochloride
CID 171196335
2-(5-chloro-2,3-difluorophenyl)pyrrolidine
CID 84785733
(2S)-2-(2,5-difluorophenyl)pyrrolidine
CID 7176288
2-(3-bromo-2,4,5-trifluorophenyl)pyrrolidine
CID 117116819
(2S)-2-(3,5-difluoro-2-methoxyphenyl)pyrrolidine
CID 66518820
2-(5-chloro-2,3-difluorophenyl)piperidine
CID 84795035
CID 174947937
CID 174947937
(3R)-3-(2,3,5-trifluorophenyl)morpholine
CID 131262758
2-(5-fluoro-3-methoxy-2-methylphenyl)pyrrolidine
CID 84677004
(2S)-2-(6-fluoro-2,3-dihydro-1H-inden-4-yl)pyrrolidine
CID 66519043
2-(2,3-difluoro-5-methylsulfonylphenyl)piperidine
CID 117440261
2-[2,3-difluoro-5-(2-fluoropropan-2-yl)phenyl]piperidine
CID 117396450

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,5-trifluorophenyl)pyrrolidine?
The IUPAC name of 2-(2,3,5-trifluorophenyl)pyrrolidine (CID 77131470) is 2-(2,3,5-trifluorophenyl)pyrrolidine.
What is the SMILES notation for 2-(2,3,5-trifluorophenyl)pyrrolidine?
The canonical SMILES for 2-(2,3,5-trifluorophenyl)pyrrolidine is Fc1cc(F)c(F)c(C2CCCN2)c1.
What is the InChIKey of 2-(2,3,5-trifluorophenyl)pyrrolidine?
The InChIKey is JPHZSASVRMNOMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h4-5,9,14H,1-3H2.
What are the key properties of 2-(2,3,5-trifluorophenyl)pyrrolidine?
2-(2,3,5-trifluorophenyl)pyrrolidine has a molecular weight of 201.19 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,5-trifluorophenyl)pyrrolidine is sourced from PubChem (CID 77131470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).