2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide

C15H21FN2O2 — CID 107694934

IUPAC2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide
SMILESCC(Oc1ccc(F)cc1CN)C(=O)NC1CCCC1
InChIInChI=1S/C15H21FN2O2/c1-10(15(19)18-13-4-2-3-5-13)20-14-7-6-12(16)8-11(14)9-17/h6-8,10,13H,2-5,9,17H2,1H3,(H,18,19)
InChIKeyGDNYRMCBVSOBLY-UHFFFAOYSA-N
MW280.34 g/mol
LogP2.11
Rot. Bonds5

About 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide

2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide (PubChem CID 107694934) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide
PubChem CID107694934
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide
SMILESCC(Oc1ccc(F)cc1CN)C(=O)NC1CCCC1
InChIInChI=1S/C15H21FN2O2/c1-10(15(19)18-13-4-2-3-5-13)20-14-7-6-12(16)8-11(14)9-17/h6-8,10,13H,2-5,9,17H2,1H3,(H,18,19)
InChIKeyGDNYRMCBVSOBLY-UHFFFAOYSA-N
XLogP2.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[4-fluoro-2-(hydroxymethyl)phenoxy]propanamide
CID 107698395
2-(2-amino-4-fluorophenoxy)-N-cyclopentylpropanamide
CID 62367828
2-(2-bromo-4-fluorophenoxy)-N-cyclopentylpropanamide
CID 43083012
2-[4-(aminomethyl)-2-fluorophenoxy]-N-cyclopentylpropanamide
CID 107665579
2-[2-(2-aminobutyl)-4-fluorophenoxy]-N-cyclopropylpropanamide
CID 107701322
2-[2-(aminomethyl)-4-fluorophenoxy]-N-(2-methylpropyl)propanamide
CID 107694652
2-[2-(2-aminoethyl)-4-chlorophenoxy]-N-cyclopentylpropanamide
CID 60905070
2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide
CID 61268519
(2S)-N-cycloheptyl-2-(2-ethylphenoxy)propanamide
CID 93488429
2-[2-(2-aminoethyl)-4-bromophenoxy]-N-cyclopentylpropanamide
CID 60905187
(2R)-N-cyclopentyl-2-(5-fluoro-2-nitrophenoxy)propanamide
CID 2631804
N-cyclopentyl-2-[2-(2-hydroxyethyl)phenoxy]propanamide
CID 107713127

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide?
The IUPAC name of 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide (CID 107694934) is 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide is CC(Oc1ccc(F)cc1CN)C(=O)NC1CCCC1.
What is the InChIKey of 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide?
The InChIKey is GDNYRMCBVSOBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-10(15(19)18-13-4-2-3-5-13)20-14-7-6-12(16)8-11(14)9-17/h6-8,10,13H,2-5,9,17H2,1H3,(H,18,19).
What are the key properties of 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide?
2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide has a molecular weight of 280.34 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide is sourced from PubChem (CID 107694934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).