2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide

C19H23FN2O3 — CID 119304879

IUPAC2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(F)ccc1Oc1ccc(C)cc1OC
InChIInChI=1S/C19H23FN2O3/c1-4-5-14(21)19(23)22-15-11-13(20)7-9-16(15)25-17-8-6-12(2)10-18(17)24-3/h6-11,14H,4-5,21H2,1-3H3,(H,22,23)
InChIKeyZSJQTQMMCLFRKT-UHFFFAOYSA-N
MW346.40 g/mol
LogP4.00
Rot. Bonds7

About 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide

2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide (PubChem CID 119304879) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide
PubChem CID119304879
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(F)ccc1Oc1ccc(C)cc1OC
InChIInChI=1S/C19H23FN2O3/c1-4-5-14(21)19(23)22-15-11-13(20)7-9-16(15)25-17-8-6-12(2)10-18(17)24-3/h6-11,14H,4-5,21H2,1-3H3,(H,22,23)
InChIKeyZSJQTQMMCLFRKT-UHFFFAOYSA-N
XLogP4.00
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide;hydrochloride
CID 120561352
(2R)-2-amino-N-(2-fluoro-4-methylphenyl)pentanamide
CID 93255538
2-amino-N-(2-fluoro-4-methylphenyl)pentanamide
CID 43650206
2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
CID 119263329
N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]-4-(methylamino)butanamide;hydrochloride
CID 119751510
2-amino-N-(4-fluoro-2-iodophenyl)pentanamide
CID 79766616
(2S)-2-amino-N-(2-bromo-5-fluorophenyl)pentanamide
CID 107625667
(2S)-2-amino-N-[2-(2-methoxyethoxy)-4-methylphenyl]pentanamide
CID 107568802
N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119751526
(2S)-2-amino-N-(4-chloro-2,5-dimethoxyphenyl)pentanamide
CID 107567961
2-amino-N-(2-ethoxy-4-fluorophenyl)pentanamide;hydrochloride
CID 119286704
2-amino-N-[2-(3-methylphenoxy)phenyl]pentanamide
CID 119266448

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide?
The IUPAC name of 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide (CID 119304879) is 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide.
What is the SMILES notation for 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide?
The canonical SMILES for 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide is CCCC(N)C(=O)Nc1cc(F)ccc1Oc1ccc(C)cc1OC.
What is the InChIKey of 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide?
The InChIKey is ZSJQTQMMCLFRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-4-5-14(21)19(23)22-15-11-13(20)7-9-16(15)25-17-8-6-12(2)10-18(17)24-3/h6-11,14H,4-5,21H2,1-3H3,(H,22,23).
What are the key properties of 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide?
2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide has a molecular weight of 346.40 g/mol, XLogP of 4.00, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]pentanamide is sourced from PubChem (CID 119304879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).