N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide

C18H22N2O3 — CID 109015125

IUPACN-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide
SMILESCOCCNC(=O)CCNc1ccccc1Oc1ccccc1
InChIInChI=1S/C18H22N2O3/c1-22-14-13-20-18(21)11-12-19-16-9-5-6-10-17(16)23-15-7-3-2-4-8-15/h2-10,19H,11-14H2,1H3,(H,20,21)
InChIKeyBISFWFWUABEMCN-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.04
Rot. Bonds9

About N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide

N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide (PubChem CID 109015125) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide
PubChem CID109015125
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC NameN-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide
SMILESCOCCNC(=O)CCNc1ccccc1Oc1ccccc1
InChIInChI=1S/C18H22N2O3/c1-22-14-13-20-18(21)11-12-19-16-9-5-6-10-17(16)23-15-7-3-2-4-8-15/h2-10,19H,11-14H2,1H3,(H,20,21)
InChIKeyBISFWFWUABEMCN-UHFFFAOYSA-N
XLogP3.04
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-phenoxyanilino)-N-propylpropanamide
CID 109011455
N-(3-methoxypropyl)-2-phenoxyaniline
CID 54935925
1-N-(2-methoxyethyl)-4-N-(2-phenoxyphenyl)benzene-1,4-dicarboxamide
CID 109045227
N-(2-methoxyethyl)-2-[2-(2-methoxyethylamino)phenoxy]aniline
CID 11120659
N-[2-(2-phenoxyanilino)ethyl]acetamide
CID 103604146
3-(2-amino-3-methylanilino)-N-(2-methoxyethyl)propanamide
CID 114041350
3-(4-methylanilino)-N-(2-phenoxyphenyl)propanamide
CID 109034509
N-benzyl-3-(2-methoxyanilino)propanamide
CID 109018840
N-butyl-3-(2-methoxyanilino)propanamide
CID 109012291
N-(2-methoxyethyl)-3-(4-phenylmethoxyanilino)propanamide
CID 109015111
N-benzyl-N-ethyl-3-(2-phenoxyanilino)propanamide
CID 109023002
N-(2-methoxyethyl)-3-(2-morpholin-4-ylanilino)propanamide
CID 109015107

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide?
The IUPAC name of N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide (CID 109015125) is N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide is COCCNC(=O)CCNc1ccccc1Oc1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide?
The InChIKey is BISFWFWUABEMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-22-14-13-20-18(21)11-12-19-16-9-5-6-10-17(16)23-15-7-3-2-4-8-15/h2-10,19H,11-14H2,1H3,(H,20,21).
What are the key properties of N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide?
N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide has a molecular weight of 314.39 g/mol, XLogP of 3.04, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-(2-phenoxyanilino)propanamide is sourced from PubChem (CID 109015125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).