N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine

C12H17FN2O — CID 115750537

IUPACN-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine
SMILESFc1cccnc1OCCNC1CCCC1
InChIInChI=1S/C12H17FN2O/c13-11-6-3-7-15-12(11)16-9-8-14-10-4-1-2-5-10/h3,6-7,10,14H,1-2,4-5,8-9H2
InChIKeyGJYJMBXWURVSIS-UHFFFAOYSA-N
MW224.28 g/mol
LogP2.13
Rot. Bonds5

About N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine

N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine (PubChem CID 115750537) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine
PubChem CID115750537
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC NameN-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine
SMILESFc1cccnc1OCCNC1CCCC1
InChIInChI=1S/C12H17FN2O/c13-11-6-3-7-15-12(11)16-9-8-14-10-4-1-2-5-10/h3,6-7,10,14H,1-2,4-5,8-9H2
InChIKeyGJYJMBXWURVSIS-UHFFFAOYSA-N
XLogP2.13
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-chlorophenyl)-[4-[2-[(3-fluoro-2-pyridinyl)oxy]ethylamino]piperidin-1-yl]methanone
CID 167794895
2-cyclopentyloxy-3-fluoropyridine
CID 126955068
N-[2-(2,6-difluorophenoxy)ethyl]cyclopropanamine
CID 81268990
N-[3-(2,6-difluorophenoxy)propyl]cyclohexanamine
CID 81269341
N-(2-quinolin-8-yloxyethyl)cyclopentanamine
CID 62599062
N-[2-(4-fluorophenoxy)ethyl]cyclohexanamine
CID 46835310
N-[2-(2,4-difluorophenoxy)ethyl]cyclopentanamine
CID 62570847
N-(2-quinolin-7-yloxyethyl)cyclohexanamine
CID 107315321
N-[2-(3-fluoro-4-methylphenoxy)ethyl]cycloheptanamine
CID 107170950
N-cyclopentyl-3-fluoropyridine-2-carboxamide
CID 83407062
N-[2-(2-fluoro-5-methylphenoxy)ethyl]cyclopentanamine
CID 64854315
N-[2-(3-chloro-4-fluorophenoxy)ethyl]cyclopentanamine
CID 55093016

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine?
The IUPAC name of N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine (CID 115750537) is N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine?
The canonical SMILES for N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine is Fc1cccnc1OCCNC1CCCC1.
What is the InChIKey of N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine?
The InChIKey is GJYJMBXWURVSIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c13-11-6-3-7-15-12(11)16-9-8-14-10-4-1-2-5-10/h3,6-7,10,14H,1-2,4-5,8-9H2.
What are the key properties of N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine?
N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine has a molecular weight of 224.28 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]cyclopentanamine is sourced from PubChem (CID 115750537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).