N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide

C22H19NO4 — CID 133239850

IUPACN-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c1
InChIInChI=1S/C22H19NO4/c1-14(26-17-7-5-6-16(13-17)25-2)22(24)23-15-10-11-19-18-8-3-4-9-20(18)27-21(19)12-15/h3-14H,1-2H3,(H,23,24)
InChIKeyVUNWJFKKWJMHSZ-UHFFFAOYSA-N
MW361.40 g/mol
LogP5.00
Rot. Bonds5

About N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide

N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide (PubChem CID 133239850) has the molecular formula C22H19NO4 and a molecular weight of 361.40 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide
PubChem CID133239850
Molecular FormulaC22H19NO4
Molecular Weight361.40 g/mol
Exact Mass361.13
IUPAC NameN-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c1
InChIInChI=1S/C22H19NO4/c1-14(26-17-7-5-6-16(13-17)25-2)22(24)23-15-10-11-19-18-8-3-4-9-20(18)27-21(19)12-15/h3-14H,1-2H3,(H,23,24)
InChIKeyVUNWJFKKWJMHSZ-UHFFFAOYSA-N
XLogP5.00
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.40
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-dibenzofuran-3-yl-2-phenoxypropanamide
CID 133234579
N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide
CID 133211026
N-dibenzofuran-3-yl-2-(2-methylphenoxy)propanamide
CID 133239743
2-(3-methoxyphenoxy)-N-(4-methoxyphenyl)propanamide
CID 19203873
N-dibenzofuran-3-yl-2-[4-[methyl(methylsulfonyl)amino]phenoxy]propanamide
CID 133234650
(2R)-N-dibenzofuran-3-yl-2-[4-[methyl(methylsulfonyl)amino]phenoxy]propanamide
CID 100553732
(2R)-N-(4-bromophenyl)-2-dibenzofuran-2-yloxypropanamide
CID 7916408
N-(4-chlorophenyl)-2-(3-methoxyphenoxy)propanamide
CID 19203909
2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 4805328
(2S)-N-(4-acetylphenyl)-2-dibenzofuran-2-yloxypropanamide
CID 30545915
N-(4-methyl-2-oxochromen-7-yl)-2-phenoxypropanamide
CID 16551217
2-(4-acetamidophenoxy)-N-(3-methoxyphenyl)propanamide
CID 4884235

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide?
The IUPAC name of N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide (CID 133239850) is N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide.
What is the SMILES notation for N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide?
The canonical SMILES for N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide is COc1cccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c1.
What is the InChIKey of N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide?
The InChIKey is VUNWJFKKWJMHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO4/c1-14(26-17-7-5-6-16(13-17)25-2)22(24)23-15-10-11-19-18-8-3-4-9-20(18)27-21(19)12-15/h3-14H,1-2H3,(H,23,24).
What are the key properties of N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide?
N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide has a molecular weight of 361.40 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide is sourced from PubChem (CID 133239850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).