N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide

C23H21NO3 — CID 133211026

IUPACN-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C
InChIInChI=1S/C23H21NO3/c1-14-8-10-18(12-15(14)2)26-16(3)23(25)24-17-9-11-20-19-6-4-5-7-21(19)27-22(20)13-17/h4-13,16H,1-3H3,(H,24,25)
InChIKeyJFTWTMVBEVVVHR-UHFFFAOYSA-N
MW359.43 g/mol
LogP5.61
Rot. Bonds4

About N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide

N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide (PubChem CID 133211026) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide
PubChem CID133211026
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC NameN-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C
InChIInChI=1S/C23H21NO3/c1-14-8-10-18(12-15(14)2)26-16(3)23(25)24-17-9-11-20-19-6-4-5-7-21(19)27-22(20)13-17/h4-13,16H,1-3H3,(H,24,25)
InChIKeyJFTWTMVBEVVVHR-UHFFFAOYSA-N
XLogP5.61
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.43
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-dibenzofuran-3-yl-2-phenoxypropanamide
CID 133234579
N-dibenzofuran-3-yl-2-(2-methylphenoxy)propanamide
CID 133239743
N-dibenzofuran-3-yl-2-(3-methoxyphenoxy)propanamide
CID 133239850
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-methyl-2-oxochromen-7-yl)-2-phenoxypropanamide
CID 16551217
(2S)-N-(4-acetylphenyl)-2-dibenzofuran-2-yloxypropanamide
CID 30545915
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53266277
N-dibenzofuran-3-yl-3,4-dimethylbenzamide
CID 3259661
(2S)-2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 7610576
2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 4805328

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide?
The IUPAC name of N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide (CID 133211026) is N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide.
What is the SMILES notation for N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide?
The canonical SMILES for N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide is Cc1ccc(OC(C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C.
What is the InChIKey of N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide?
The InChIKey is JFTWTMVBEVVVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-14-8-10-18(12-15(14)2)26-16(3)23(25)24-17-9-11-20-19-6-4-5-7-21(19)27-22(20)13-17/h4-13,16H,1-3H3,(H,24,25).
What are the key properties of N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide?
N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide has a molecular weight of 359.43 g/mol, XLogP of 5.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-2-(3,4-dimethylphenoxy)propanamide is sourced from PubChem (CID 133211026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).