N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide

C23H24N2O4 — CID 55362447

IUPACN-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide
SMILESCOc1ccc(OC)c(NC(=O)C(C)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O4/c1-16(23(26)25-21-15-20(27-2)13-14-22(21)28-3)24-17-9-11-19(12-10-17)29-18-7-5-4-6-8-18/h4-16,24H,1-3H3,(H,25,26)
InChIKeyOGGCVQPNAIALTM-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.94
Rot. Bonds8

About N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide

N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide (PubChem CID 55362447) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide
PubChem CID55362447
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide
SMILESCOc1ccc(OC)c(NC(=O)C(C)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O4/c1-16(23(26)25-21-15-20(27-2)13-14-22(21)28-3)24-17-9-11-19(12-10-17)29-18-7-5-4-6-8-18/h4-16,24H,1-3H3,(H,25,26)
InChIKeyOGGCVQPNAIALTM-UHFFFAOYSA-N
XLogP4.94
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(2-methoxy-5-methylphenyl)-2-(4-phenoxyanilino)propanamide
CID 40799840
(2S)-N-(2-methoxy-5-methylphenyl)-2-(4-phenoxyanilino)propanamide
CID 40799845
(2R)-2-(2,4-dimethoxyanilino)-N-(4-phenoxyphenyl)propanamide
CID 25385741
N-(2,5-dimethoxyphenyl)-2-(4-ethylanilino)propanamide
CID 51178496
N-(2,5-dimethoxyphenyl)-2-(3,4-dimethylanilino)propanamide
CID 51178285
2-(4-methoxyanilino)-N-(2-methoxyphenyl)propanamide
CID 17397275
(2S)-N-(4-acetamidophenyl)-2-(4-phenoxyanilino)propanamide
CID 7830436
(2R)-2-[4-methoxy-3-(4-methoxyphenoxy)anilino]-N-(3-methoxyphenyl)propanamide
CID 30296852
N-(2-chlorophenyl)-2-[4-methoxy-3-(4-methoxyphenoxy)anilino]propanamide
CID 18289314
(2S)-N-(2,5-dimethoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
CID 25351726
N-methyl-2-(4-phenoxyanilino)propanamide
CID 43085961
(2S)-N-(2,5-dimethoxyphenyl)-2-[4-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 25354796

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide (CID 55362447) is N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide is COc1ccc(OC)c(NC(=O)C(C)Nc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide?
The InChIKey is OGGCVQPNAIALTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-16(23(26)25-21-15-20(27-2)13-14-22(21)28-3)24-17-9-11-19(12-10-17)29-18-7-5-4-6-8-18/h4-16,24H,1-3H3,(H,25,26).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide?
N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide has a molecular weight of 392.46 g/mol, XLogP of 4.94, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(4-phenoxyanilino)propanamide is sourced from PubChem (CID 55362447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).