2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide

C15H22FNO3 — CID 60656685

IUPAC2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide
SMILESCCCN(CCO)C(=O)C(C)(C)Oc1ccc(F)cc1
InChIInChI=1S/C15H22FNO3/c1-4-9-17(10-11-18)14(19)15(2,3)20-13-7-5-12(16)6-8-13/h5-8,18H,4,9-11H2,1-3H3
InChIKeyXMOILNVJNRCWGT-UHFFFAOYSA-N
MW283.34 g/mol
LogP2.21
Rot. Bonds7

About 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide

2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide (PubChem CID 60656685) has the molecular formula C15H22FNO3 and a molecular weight of 283.34 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide
PubChem CID60656685
Molecular FormulaC15H22FNO3
Molecular Weight283.34 g/mol
Exact Mass283.16
IUPAC Name2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide
SMILESCCCN(CCO)C(=O)C(C)(C)Oc1ccc(F)cc1
InChIInChI=1S/C15H22FNO3/c1-4-9-17(10-11-18)14(19)15(2,3)20-13-7-5-12(16)6-8-13/h5-8,18H,4,9-11H2,1-3H3
InChIKeyXMOILNVJNRCWGT-UHFFFAOYSA-N
XLogP2.21
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide (CID 60656685) is 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide is CCCN(CCO)C(=O)C(C)(C)Oc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide?
The InChIKey is XMOILNVJNRCWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO3/c1-4-9-17(10-11-18)14(19)15(2,3)20-13-7-5-12(16)6-8-13/h5-8,18H,4,9-11H2,1-3H3.
What are the key properties of 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide?
2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide has a molecular weight of 283.34 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propylpropanamide is sourced from PubChem (CID 60656685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).