3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine

C10H12ClFN2O — CID 79734556

IUPAC3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine
SMILESNC1CCC(Oc2ncc(Cl)cc2F)C1
InChIInChI=1S/C10H12ClFN2O/c11-6-3-9(12)10(14-5-6)15-8-2-1-7(13)4-8/h3,5,7-8H,1-2,4,13H2
InChIKeyRECADJSLHAHXCA-UHFFFAOYSA-N
MW230.67 g/mol
LogP2.13
Rot. Bonds2

About 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine

3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine (PubChem CID 79734556) has the molecular formula C10H12ClFN2O and a molecular weight of 230.67 g/mol. Its IUPAC name is 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine
PubChem CID79734556
Molecular FormulaC10H12ClFN2O
Molecular Weight230.67 g/mol
Exact Mass230.06
IUPAC Name3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine
SMILESNC1CCC(Oc2ncc(Cl)cc2F)C1
InChIInChI=1S/C10H12ClFN2O/c11-6-3-9(12)10(14-5-6)15-8-2-1-7(13)4-8/h3,5,7-8H,1-2,4,13H2
InChIKeyRECADJSLHAHXCA-UHFFFAOYSA-N
XLogP2.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.67
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine?
The IUPAC name of 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine (CID 79734556) is 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine.
What is the SMILES notation for 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine?
The canonical SMILES for 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine is NC1CCC(Oc2ncc(Cl)cc2F)C1.
What is the InChIKey of 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine?
The InChIKey is RECADJSLHAHXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClFN2O/c11-6-3-9(12)10(14-5-6)15-8-2-1-7(13)4-8/h3,5,7-8H,1-2,4,13H2.
What are the key properties of 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine?
3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine has a molecular weight of 230.67 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]cyclopentan-1-amine is sourced from PubChem (CID 79734556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).