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

C22H18FNO4 — CID 7815222

IUPAC(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@H](C)Oc1ccccc1F)oc1ccccc12
InChIInChI=1S/C22H18FNO4/c1-13(27-19-10-6-4-8-16(19)23)22(25)24-17-12-20-15(11-21(17)26-2)14-7-3-5-9-18(14)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1
InChIKeyDUEBFLBCHUJJRL-ZDUSSCGKSA-N
MW379.39 g/mol
LogP5.14
Rot. Bonds5

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

(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (PubChem CID 7815222) has the molecular formula C22H18FNO4 and a molecular weight of 379.39 g/mol. Its IUPAC name is (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
PubChem CID7815222
Molecular FormulaC22H18FNO4
Molecular Weight379.39 g/mol
Exact Mass379.12
IUPAC Name(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@H](C)Oc1ccccc1F)oc1ccccc12
InChIInChI=1S/C22H18FNO4/c1-13(27-19-10-6-4-8-16(19)23)22(25)24-17-12-20-15(11-21(17)26-2)14-7-3-5-9-18(14)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1
InChIKeyDUEBFLBCHUJJRL-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

(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7962389
2-(2,3-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 18291295
(2S)-2-(4-chloro-2-methylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7916291
2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 4805328
(2S)-2-(2-fluorophenyl)sulfanyl-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7484407
[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7811454
[1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 3,5-difluorobenzoate
CID 3980526
2-(3-ethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 22831051
2-(4-fluorophenyl)ethyl-[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl]azanium
CID 2402947
(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
(2S)-2-(3,4-difluorophenyl)sulfanyl-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7737162

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The IUPAC name of (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (CID 7815222) is (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.
What is the SMILES notation for (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The canonical SMILES for (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is COc1cc2c(cc1NC(=O)[C@H](C)Oc1ccccc1F)oc1ccccc12.
What is the InChIKey of (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The InChIKey is DUEBFLBCHUJJRL-ZDUSSCGKSA-N. The full InChI is InChI=1S/C22H18FNO4/c1-13(27-19-10-6-4-8-16(19)23)22(25)24-17-12-20-15(11-21(17)26-2)14-7-3-5-9-18(14)28-20/h3-13H,1-2H3,(H,24,25)/t13-/m0/s1.
What are the key properties of (2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
(2S)-2-(2-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-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is sourced from PubChem (CID 7815222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).