3-(2-fluorophenoxy)-N-propylpropanamide

C12H16FNO2 — CID 60637780

IUPAC3-(2-fluorophenoxy)-N-propylpropanamide
SMILESCCCNC(=O)CCOc1ccccc1F
InChIInChI=1S/C12H16FNO2/c1-2-8-14-12(15)7-9-16-11-6-4-3-5-10(11)13/h3-6H,2,7-9H2,1H3,(H,14,15)
InChIKeyUHZRAACTHVSVHZ-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.12
Rot. Bonds6

About 3-(2-fluorophenoxy)-N-propylpropanamide

3-(2-fluorophenoxy)-N-propylpropanamide (PubChem CID 60637780) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is 3-(2-fluorophenoxy)-N-propylpropanamide.

Molecular Properties

Compound Name3-(2-fluorophenoxy)-N-propylpropanamide
PubChem CID60637780
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name3-(2-fluorophenoxy)-N-propylpropanamide
SMILESCCCNC(=O)CCOc1ccccc1F
InChIInChI=1S/C12H16FNO2/c1-2-8-14-12(15)7-9-16-11-6-4-3-5-10(11)13/h3-6H,2,7-9H2,1H3,(H,14,15)
InChIKeyUHZRAACTHVSVHZ-UHFFFAOYSA-N
XLogP2.12
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-fluorophenoxy)-N-(2-hydroxyethyl)propanamide
CID 43388959
N-[2-(ethylamino)ethyl]-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119505851
N-(2-aminoethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119382925
4-[3-(2-fluorophenoxy)propanoylamino]-2-methylbutanoic acid
CID 80538101
3-(2,5-dimethylphenoxy)-N-[2-(2-fluorophenoxy)ethyl]propanamide
CID 7927608
3-(2-fluorophenoxy)-N-(2-hydroxy-2-methylpropyl)propanamide
CID 65109845
3-(2-fluorophenoxy)-N-methoxypropanamide
CID 60717911
N-[(2R)-2-(ethylamino)propyl]-3-(2-fluorophenoxy)propanamide
CID 120650525
3-[3-(2-fluorophenoxy)propanoylamino]-2,2-dimethylpropanoic acid
CID 81370073
3-(2-fluorophenoxy)-N-[2-(methylamino)propyl]propanamide
CID 120831531
3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide
CID 78779605
N-[2-(2-fluorophenoxy)ethyl]-3-(methanesulfonamido)propanamide
CID 131921415

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenoxy)-N-propylpropanamide?
The IUPAC name of 3-(2-fluorophenoxy)-N-propylpropanamide (CID 60637780) is 3-(2-fluorophenoxy)-N-propylpropanamide.
What is the SMILES notation for 3-(2-fluorophenoxy)-N-propylpropanamide?
The canonical SMILES for 3-(2-fluorophenoxy)-N-propylpropanamide is CCCNC(=O)CCOc1ccccc1F.
What is the InChIKey of 3-(2-fluorophenoxy)-N-propylpropanamide?
The InChIKey is UHZRAACTHVSVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-2-8-14-12(15)7-9-16-11-6-4-3-5-10(11)13/h3-6H,2,7-9H2,1H3,(H,14,15).
What are the key properties of 3-(2-fluorophenoxy)-N-propylpropanamide?
3-(2-fluorophenoxy)-N-propylpropanamide has a molecular weight of 225.26 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenoxy)-N-propylpropanamide is sourced from PubChem (CID 60637780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).