(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide

C18H20FNO3 — CID 94633905

IUPAC(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide
SMILESCc1ccccc1OCCNC(=O)[C@@H](C)Oc1ccc(F)cc1
InChIInChI=1S/C18H20FNO3/c1-13-5-3-4-6-17(13)22-12-11-20-18(21)14(2)23-16-9-7-15(19)8-10-16/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m1/s1
InChIKeyRYTAJIPHGSILRB-CQSZACIVSA-N
MW317.36 g/mol
LogP3.10
Rot. Bonds7

About (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide

(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide (PubChem CID 94633905) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide
PubChem CID94633905
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide
SMILESCc1ccccc1OCCNC(=O)[C@@H](C)Oc1ccc(F)cc1
InChIInChI=1S/C18H20FNO3/c1-13-5-3-4-6-17(13)22-12-11-20-18(21)14(2)23-16-9-7-15(19)8-10-16/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m1/s1
InChIKeyRYTAJIPHGSILRB-CQSZACIVSA-N
XLogP3.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-[2-(2-methylphenoxy)ethyl]-2-phenoxypropanamide
CID 94633957
N-[2-(2-chlorophenoxy)ethyl]-2-(4-fluorophenoxy)propanamide
CID 133164174
2-[4-[methyl(methylsulfonyl)amino]phenoxy]-N-[2-(2-methylphenoxy)ethyl]propanamide
CID 133218709
2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 43915467
2-(3,4-dimethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]propanamide
CID 133211025
(2R)-N-[2-(3,5-dimethylphenoxy)ethyl]-2-(4-fluorophenoxy)propanamide
CID 95161756
2-(4-bromophenoxy)-N-[2-(2-fluorophenoxy)ethyl]propanamide
CID 18113570
(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide
CID 37363339
N-[2-(4-fluorophenoxy)ethyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 133239810
N-[2-(2,5-dimethylphenoxy)ethyl]-2-(2-methylphenoxy)propanamide
CID 133166083
2-(2-methylphenoxy)-N-(2-naphthalen-1-yloxyethyl)propanamide
CID 133220515
(2S)-2-(4-chlorophenoxy)-N-[2-(2-methoxyphenoxy)ethyl]propanamide
CID 92540063

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide?
The IUPAC name of (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide (CID 94633905) is (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide.
What is the SMILES notation for (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide?
The canonical SMILES for (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide is Cc1ccccc1OCCNC(=O)[C@@H](C)Oc1ccc(F)cc1.
What is the InChIKey of (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide?
The InChIKey is RYTAJIPHGSILRB-CQSZACIVSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-13-5-3-4-6-17(13)22-12-11-20-18(21)14(2)23-16-9-7-15(19)8-10-16/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m1/s1.
What are the key properties of (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide?
(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide has a molecular weight of 317.36 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide is sourced from PubChem (CID 94633905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).