trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine

C11H14FN — CID 94827218

IUPACtrans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
SMILESN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C11H14FN/c12-10-4-1-8(2-5-10)9-3-6-11(13)7-9/h1-2,4-5,9,11H,3,6-7,13H2/t9-,11-/m1/s1
InChIKeyUPLDSIAYBNJSTF-MWLCHTKSSA-N
MW179.24 g/mol
LogP2.42
Rot. Bonds1

About trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine

trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine (PubChem CID 94827218) has the molecular formula C11H14FN and a molecular weight of 179.24 g/mol. Its IUPAC name is trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine.

Molecular Properties

Compound Nametrans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
PubChem CID94827218
Molecular FormulaC11H14FN
Molecular Weight179.24 g/mol
Exact Mass179.11
IUPAC Nametrans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
SMILESN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C11H14FN/c12-10-4-1-8(2-5-10)9-3-6-11(13)7-9/h1-2,4-5,9,11H,3,6-7,13H2/t9-,11-/m1/s1
InChIKeyUPLDSIAYBNJSTF-MWLCHTKSSA-N
XLogP2.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-(1R,3S)-3-(4-fluorophenyl)cyclohexan-1-amine;hydrochloride
CID 168719722
3-(4-cyclobutylphenyl)cyclopentan-1-amine
CID 116506752
1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
CID 122631633
3-(3,5-difluorophenyl)cyclopentan-1-amine
CID 64503877
1-(3-chlorocyclopentyl)-4-fluorobenzene
CID 64515664
trans-(1R,3R)-3-(4-prop-1-ynylphenyl)cyclopentan-1-amine
CID 141211636
5-fluoro-1-[(1R)-3-(4-fluorophenyl)cyclopentyl]piperidin-3-amine
CID 167117559
1-fluoro-4-(4-fluorocyclohexyl)benzene
CID 23539867
3-(4-fluorophenyl)-8-azabicyclo[3.2.1]octane
CID 22012229
1-[4-(bromomethyl)cyclohexyl]-4-fluorobenzene
CID 177244995
3-(3,5-difluorophenyl)cycloheptan-1-amine
CID 64505323
3-(3,5-difluorophenyl)cyclohexan-1-amine
CID 64503888

Frequently Asked Questions

What is the IUPAC name of trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine?
The IUPAC name of trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine (CID 94827218) is trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine.
What is the SMILES notation for trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine?
The canonical SMILES for trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine is N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1.
What is the InChIKey of trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine?
The InChIKey is UPLDSIAYBNJSTF-MWLCHTKSSA-N. The full InChI is InChI=1S/C11H14FN/c12-10-4-1-8(2-5-10)9-3-6-11(13)7-9/h1-2,4-5,9,11H,3,6-7,13H2/t9-,11-/m1/s1.
What are the key properties of trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine?
trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine has a molecular weight of 179.24 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine is sourced from PubChem (CID 94827218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).