(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide

C22H18FNO4 — CID 7962389

IUPAC(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@H](C)Oc1ccc(F)cc1)oc1ccccc12
InChIInChI=1S/C22H18FNO4/c1-13(27-15-9-7-14(23)8-10-15)22(25)24-18-12-20-17(11-21(18)26-2)16-5-3-4-6-19(16)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1
InChIKeyIDPOARZAEBCVAW-ZDUSSCGKSA-N
MW379.39 g/mol
LogP5.14
Rot. Bonds5

About (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide

(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (PubChem CID 7962389) has the molecular formula C22H18FNO4 and a molecular weight of 379.39 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
PubChem CID7962389
Molecular FormulaC22H18FNO4
Molecular Weight379.39 g/mol
Exact Mass379.12
IUPAC Name(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@H](C)Oc1ccc(F)cc1)oc1ccccc12
InChIInChI=1S/C22H18FNO4/c1-13(27-15-9-7-14(23)8-10-15)22(25)24-18-12-20-17(11-21(18)26-2)16-5-3-4-6-19(16)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1
InChIKeyIDPOARZAEBCVAW-ZDUSSCGKSA-N
XLogP5.14
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.39
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 4805328
(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7815222
2-(3-ethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 22831051
2-(2,3-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 18291295
[1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 3,5-difluorobenzoate
CID 3980526
N-(2-methoxydibenzofuran-3-yl)-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 47004283
[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7811454
2-(4-fluorophenyl)ethyl-[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl]azanium
CID 2402947
(2R)-2-[2-(4-fluorophenyl)ethylamino]-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2402948
(2S)-2-(4-chloro-2-methylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7916291
(2S)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylquinolin-2-yl)oxypropanamide
CID 25411874
N-(2-methoxydibenzofuran-3-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674201

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The IUPAC name of (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (CID 7962389) is (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.
What is the SMILES notation for (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The canonical SMILES for (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is COc1cc2c(cc1NC(=O)[C@H](C)Oc1ccc(F)cc1)oc1ccccc12.
What is the InChIKey of (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The InChIKey is IDPOARZAEBCVAW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C22H18FNO4/c1-13(27-15-9-7-14(23)8-10-15)22(25)24-18-12-20-17(11-21(18)26-2)16-5-3-4-6-19(16)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide has a molecular weight of 379.39 g/mol, XLogP of 5.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is sourced from PubChem (CID 7962389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).