1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine

C15H20F2N2 — CID 62275065

IUPAC1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
SMILESFc1ccc(F)c(CN2CCCC2C2CCCN2)c1
InChIInChI=1S/C15H20F2N2/c16-12-5-6-13(17)11(9-12)10-19-8-2-4-15(19)14-3-1-7-18-14/h5-6,9,14-15,18H,1-4,7-8,10H2
InChIKeyCYQJCUZTUFKPKF-UHFFFAOYSA-N
MW266.33 g/mol
LogP2.68
Rot. Bonds3

About 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine

1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine (PubChem CID 62275065) has the molecular formula C15H20F2N2 and a molecular weight of 266.33 g/mol. Its IUPAC name is 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine.

Molecular Properties

Compound Name1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
PubChem CID62275065
Molecular FormulaC15H20F2N2
Molecular Weight266.33 g/mol
Exact Mass266.16
IUPAC Name1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
SMILESFc1ccc(F)c(CN2CCCC2C2CCCN2)c1
InChIInChI=1S/C15H20F2N2/c16-12-5-6-13(17)11(9-12)10-19-8-2-4-15(19)14-3-1-7-18-14/h5-6,9,14-15,18H,1-4,7-8,10H2
InChIKeyCYQJCUZTUFKPKF-UHFFFAOYSA-N
XLogP2.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(5-bromo-2-fluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 62273349
3-fluoro-4-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]benzonitrile
CID 62274768
2-[1-[(2,5-difluorophenyl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339484
1-[(2-bromo-5-chlorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 66157263
2-pyrrolidin-2-yl-1-[(2,4,5-trimethylphenyl)methyl]pyrrolidine
CID 104869393
3-fluoro-4-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]benzamide
CID 62274944
1-[(2,5-dimethylphenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 55054099
1-[(2,5-dimethoxyphenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 62274395
1-[(2,6-difluorophenyl)methyl]-2-pyrrolidin-2-ylpiperidine
CID 63256349
(3aR,8aR)-4-[(3-fluorophenyl)methyl]-2,3,3a,5,6,7,8,8a-octahydro-1H-pyrrolo[3,2-b]azepine
CID 178143551
1-[(4-chloro-3-fluorophenyl)methyl]-2-pyrrolidin-2-ylpiperidine
CID 63256226
1-[(2-fluoro-3-nitrophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine
CID 107350255

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine?
The IUPAC name of 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine (CID 62275065) is 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine.
What is the SMILES notation for 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine?
The canonical SMILES for 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine is Fc1ccc(F)c(CN2CCCC2C2CCCN2)c1.
What is the InChIKey of 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine?
The InChIKey is CYQJCUZTUFKPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2/c16-12-5-6-13(17)11(9-12)10-19-8-2-4-15(19)14-3-1-7-18-14/h5-6,9,14-15,18H,1-4,7-8,10H2.
What are the key properties of 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine?
1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine has a molecular weight of 266.33 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylpyrrolidine is sourced from PubChem (CID 62275065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).