1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine

C15H21FN2 — CID 117374393

IUPAC1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine
SMILESNC1(c2cc(F)ccc2N2CCCC2)CCCC1
InChIInChI=1S/C15H21FN2/c16-12-5-6-14(18-9-3-4-10-18)13(11-12)15(17)7-1-2-8-15/h5-6,11H,1-4,7-10,17H2
InChIKeyITFFYCHVAMNYTB-UHFFFAOYSA-N
MW248.34 g/mol
LogP3.15
Rot. Bonds2

About 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine

1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine (PubChem CID 117374393) has the molecular formula C15H21FN2 and a molecular weight of 248.34 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine
PubChem CID117374393
Molecular FormulaC15H21FN2
Molecular Weight248.34 g/mol
Exact Mass248.17
IUPAC Name1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine
SMILESNC1(c2cc(F)ccc2N2CCCC2)CCCC1
InChIInChI=1S/C15H21FN2/c16-12-5-6-14(18-9-3-4-10-18)13(11-12)15(17)7-1-2-8-15/h5-6,11H,1-4,7-10,17H2
InChIKeyITFFYCHVAMNYTB-UHFFFAOYSA-N
XLogP3.15
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopropan-1-ol
CID 117316011
1-(5-chloro-2-piperidin-1-ylphenyl)cyclopentan-1-amine
CID 117447140
1-(2,5-difluorophenyl)cyclopentan-1-amine
CID 62802401
1-[4-fluoro-2-(1-isocyanatocyclopentyl)phenyl]piperidine
CID 117465962
1-(5-fluoro-2-piperidin-1-ylphenyl)cyclobutane-1-carboxylic acid
CID 117444326
1-(2-bromo-5-fluorophenyl)cyclohexan-1-amine
CID 117432906
2-(1-aminocyclohexyl)-4-fluorobenzaldehyde
CID 117315954
[1-(4-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentyl]methanamine
CID 117113346
2-(azepan-1-yl)-5-fluoroaniline
CID 6485407
2-(azocan-1-yl)-5-fluoroaniline
CID 28799703
1-(2,4-difluorophenyl)cyclohexan-1-amine
CID 62802198
5-fluoro-2-piperidin-1-ylaniline
CID 6485403

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine?
The IUPAC name of 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine (CID 117374393) is 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine?
The canonical SMILES for 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine is NC1(c2cc(F)ccc2N2CCCC2)CCCC1.
What is the InChIKey of 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine?
The InChIKey is ITFFYCHVAMNYTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2/c16-12-5-6-14(18-9-3-4-10-18)13(11-12)15(17)7-1-2-8-15/h5-6,11H,1-4,7-10,17H2.
What are the key properties of 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine?
1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine has a molecular weight of 248.34 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 117374393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).