N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide

C14H20FNO3 — CID 115771406

IUPACN-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
SMILESCCN(CCCO)C(=O)C(C)Oc1ccc(F)cc1
InChIInChI=1S/C14H20FNO3/c1-3-16(9-4-10-17)14(18)11(2)19-13-7-5-12(15)6-8-13/h5-8,11,17H,3-4,9-10H2,1-2H3
InChIKeyKEGFVDAWESZFGB-UHFFFAOYSA-N
MW269.32 g/mol
LogP1.82
Rot. Bonds7

About N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide

N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide (PubChem CID 115771406) has the molecular formula C14H20FNO3 and a molecular weight of 269.32 g/mol. Its IUPAC name is N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide.

Molecular Properties

Compound NameN-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
PubChem CID115771406
Molecular FormulaC14H20FNO3
Molecular Weight269.32 g/mol
Exact Mass269.14
IUPAC NameN-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
SMILESCCN(CCCO)C(=O)C(C)Oc1ccc(F)cc1
InChIInChI=1S/C14H20FNO3/c1-3-16(9-4-10-17)14(18)11(2)19-13-7-5-12(15)6-8-13/h5-8,11,17H,3-4,9-10H2,1-2H3
InChIKeyKEGFVDAWESZFGB-UHFFFAOYSA-N
XLogP1.82
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-N-propylpropanamide
CID 60656705
N-butyl-N-ethyl-2-phenoxypropanamide
CID 2915016
(2S)-N,N-diethyl-2-(4-fluorophenoxy)butanamide
CID 94016182
3-[2-(4-fluorophenoxy)propanoyl-(2-methylpropyl)amino]propanoic acid
CID 119189911
2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide
CID 115771866
2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 43391422
N,N-diethyl-2-[3-fluoro-4-(1-hydroxyethyl)phenoxy]propanamide
CID 107719457
2-(4-tert-butylphenoxy)-N,N-diethylpropanamide
CID 19204171
2-[4-[(1S)-1-aminoethyl]phenoxy]-N,N-diethylpropanamide
CID 63367483
2-(2,5-dimethylphenoxy)-N-ethyl-N-(4-hydroxybutyl)propanamide
CID 46997752
2-(4-cyanophenoxy)-N,N-diethylpropanamide
CID 43083146
2-(4-fluorophenoxy)propanoic acid
CID 3872140

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The IUPAC name of N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide (CID 115771406) is N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide.
What is the SMILES notation for N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The canonical SMILES for N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide is CCN(CCCO)C(=O)C(C)Oc1ccc(F)cc1.
What is the InChIKey of N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The InChIKey is KEGFVDAWESZFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO3/c1-3-16(9-4-10-17)14(18)11(2)19-13-7-5-12(15)6-8-13/h5-8,11,17H,3-4,9-10H2,1-2H3.
What are the key properties of N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide has a molecular weight of 269.32 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide is sourced from PubChem (CID 115771406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).