N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide

C24H24N2O5 — CID 2972138

IUPACN-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide
SMILESCOc1cc(NC(=O)C(C)Oc2ccccc2)ccc1NC(=O)COc1ccccc1
InChIInChI=1S/C24H24N2O5/c1-17(31-20-11-7-4-8-12-20)24(28)25-18-13-14-21(22(15-18)29-2)26-23(27)16-30-19-9-5-3-6-10-19/h3-15,17H,16H2,1-2H3,(H,25,28)(H,26,27)
InChIKeyZOYZFYZLSUZVDN-UHFFFAOYSA-N
MW420.47 g/mol
LogP4.12
Rot. Bonds9

About N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide

N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide (PubChem CID 2972138) has the molecular formula C24H24N2O5 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide
PubChem CID2972138
Molecular FormulaC24H24N2O5
Molecular Weight420.47 g/mol
Exact Mass420.17
IUPAC NameN-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide
SMILESCOc1cc(NC(=O)C(C)Oc2ccccc2)ccc1NC(=O)COc1ccccc1
InChIInChI=1S/C24H24N2O5/c1-17(31-20-11-7-4-8-12-20)24(28)25-18-13-14-21(22(15-18)29-2)26-23(27)16-30-19-9-5-3-6-10-19/h3-15,17H,16H2,1-2H3,(H,25,28)(H,26,27)
InChIKeyZOYZFYZLSUZVDN-UHFFFAOYSA-N
XLogP4.12
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenoxy-N-(3,4,5-trimethoxyphenyl)propanamide
CID 2991764
2-[4-(2-phenoxypropanoylamino)phenoxy]acetic acid
CID 2898320
N-(4-acetamido-3-methoxyphenyl)-2-methoxypropanamide
CID 47308212
N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide
CID 46550285
N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
N-[3-(2-methylprop-2-enoxy)phenyl]-2-phenoxypropanamide
CID 17122473
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872
(2S)-N-(4-ethoxy-3-methoxyphenyl)-2-(3-methylphenoxy)propanamide
CID 39729674
[1-(2-methoxyanilino)-1-oxopropan-2-yl] 4-[2-(3-methoxyanilino)-2-oxoethoxy]benzoate
CID 16538926
(2R)-2-(2-methoxyphenoxy)-N-naphthalen-2-ylpropanamide
CID 805506
2-chloro-N-[4-[[2-(4-chlorophenoxy)acetyl]amino]-2-methoxyphenyl]benzamide
CID 17111369
2-(4-bromo-2,6-dimethylphenoxy)-N-[3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 17231402

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide?
The IUPAC name of N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide (CID 2972138) is N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide?
The canonical SMILES for N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide is COc1cc(NC(=O)C(C)Oc2ccccc2)ccc1NC(=O)COc1ccccc1.
What is the InChIKey of N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide?
The InChIKey is ZOYZFYZLSUZVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O5/c1-17(31-20-11-7-4-8-12-20)24(28)25-18-13-14-21(22(15-18)29-2)26-23(27)16-30-19-9-5-3-6-10-19/h3-15,17H,16H2,1-2H3,(H,25,28)(H,26,27).
What are the key properties of N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide?
N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide has a molecular weight of 420.47 g/mol, XLogP of 4.12, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide is sourced from PubChem (CID 2972138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).