N-[3-(3-fluorophenoxy)propyl]cyclopentanamine

C14H20FNO — CID 62571696

IUPACN-[3-(3-fluorophenoxy)propyl]cyclopentanamine
SMILESFc1cccc(OCCCNC2CCCC2)c1
InChIInChI=1S/C14H20FNO/c15-12-5-3-8-14(11-12)17-10-4-9-16-13-6-1-2-7-13/h3,5,8,11,13,16H,1-2,4,6-7,9-10H2
InChIKeyBZMZPQDKDYVZCK-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.13
Rot. Bonds6

About N-[3-(3-fluorophenoxy)propyl]cyclopentanamine

N-[3-(3-fluorophenoxy)propyl]cyclopentanamine (PubChem CID 62571696) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is N-[3-(3-fluorophenoxy)propyl]cyclopentanamine.

Molecular Properties

Compound NameN-[3-(3-fluorophenoxy)propyl]cyclopentanamine
PubChem CID62571696
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC NameN-[3-(3-fluorophenoxy)propyl]cyclopentanamine
SMILESFc1cccc(OCCCNC2CCCC2)c1
InChIInChI=1S/C14H20FNO/c15-12-5-3-8-14(11-12)17-10-4-9-16-13-6-1-2-7-13/h3,5,8,11,13,16H,1-2,4,6-7,9-10H2
InChIKeyBZMZPQDKDYVZCK-UHFFFAOYSA-N
XLogP3.13
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(3-fluorophenoxy)ethyl]cyclopropanamine
CID 29015732
N-[3-(4-fluorophenoxy)propyl]cyclohexanamine
CID 60683502
N-(3-phenoxypropyl)cyclohexanamine
CID 60683732
N-[3-(3-ethylphenoxy)propyl]cyclohexanamine
CID 62598986
N-[2-(3-methylphenoxy)ethyl]cyclopentanamine
CID 54798962
N-[3-(4-chloro-3-fluorophenoxy)propyl]cyclopentanamine
CID 82727453
N-[3-(3-bromo-4-fluorophenoxy)propyl]cyclopentanamine
CID 83234514
N-[3-(2,6-difluorophenoxy)propyl]cyclohexanamine
CID 81269341
N-[3-(2,5-difluorophenoxy)propyl]cyclohexanamine
CID 63273078
N-[2-(4-fluorophenoxy)ethyl]cyclohexanamine
CID 46835310
1-cyclopentyl-3-[2-(3-fluorophenoxy)ethyl]-2-methylguanidine;hydroiodide
CID 110990204
N-[3-(2-chloro-4-fluorophenoxy)propyl]cyclopentanamine
CID 62598567

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluorophenoxy)propyl]cyclopentanamine?
The IUPAC name of N-[3-(3-fluorophenoxy)propyl]cyclopentanamine (CID 62571696) is N-[3-(3-fluorophenoxy)propyl]cyclopentanamine.
What is the SMILES notation for N-[3-(3-fluorophenoxy)propyl]cyclopentanamine?
The canonical SMILES for N-[3-(3-fluorophenoxy)propyl]cyclopentanamine is Fc1cccc(OCCCNC2CCCC2)c1.
What is the InChIKey of N-[3-(3-fluorophenoxy)propyl]cyclopentanamine?
The InChIKey is BZMZPQDKDYVZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c15-12-5-3-8-14(11-12)17-10-4-9-16-13-6-1-2-7-13/h3,5,8,11,13,16H,1-2,4,6-7,9-10H2.
What are the key properties of N-[3-(3-fluorophenoxy)propyl]cyclopentanamine?
N-[3-(3-fluorophenoxy)propyl]cyclopentanamine has a molecular weight of 237.32 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluorophenoxy)propyl]cyclopentanamine is sourced from PubChem (CID 62571696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).