2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide

C15H24N2O4 — CID 103404950

IUPAC2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide
SMILESCOCCOCCCOCC(N)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H24N2O4/c1-19-10-11-20-8-5-9-21-12-15(17,14(16)18)13-6-3-2-4-7-13/h2-4,6-7H,5,8-12,17H2,1H3,(H2,16,18)
InChIKeyIHGUIDHEXRROOL-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.40
Rot. Bonds11

About 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide

2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide (PubChem CID 103404950) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide
PubChem CID103404950
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide
SMILESCOCCOCCCOCC(N)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H24N2O4/c1-19-10-11-20-8-5-9-21-12-15(17,14(16)18)13-6-3-2-4-7-13/h2-4,6-7H,5,8-12,17H2,1H3,(H2,16,18)
InChIKeyIHGUIDHEXRROOL-UHFFFAOYSA-N
XLogP0.40
TPSA96.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-amino-4-(2-methoxyethoxy)-1-phenylbutan-1-ol
CID 19098989
2-(aminomethyl)-5-(2-methoxyethoxy)-2-phenylpentanoic acid
CID 106489358
methyl 2-amino-2-phenyl-3-(3,3,3-trifluoropropoxy)propanoate
CID 82958729
2-(aminomethyl)-4-(3-methoxypropoxy)-2-phenylbutanoic acid
CID 106489385
2-amino-3-pentan-2-yloxy-2-phenylpropanamide
CID 102984296
2-amino-N-[2-(2-methoxyethoxy)ethyl]-2-phenylpropanamide
CID 55078489
2-amino-4-(cyclohexylmethoxy)-2-phenylbutanamide
CID 116694375
3-[3-(2-methoxyethoxy)propoxy]-2-(methylamino)-2-phenylpropanenitrile
CID 103404528
3-[3-(2-methoxyethoxy)propoxy]benzoic acid
CID 63073270
2,2-difluoro-2-[3-[2-(2-methoxyethoxy)ethoxy]phenyl]acetamide
CID 155796910
2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide
CID 63654675
2-amino-3-[2-methoxyethyl(propan-2-yl)amino]-2-phenylpropanoic acid
CID 82960250

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide?
The IUPAC name of 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide (CID 103404950) is 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide?
The canonical SMILES for 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide is COCCOCCCOCC(N)(C(N)=O)c1ccccc1.
What is the InChIKey of 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide?
The InChIKey is IHGUIDHEXRROOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-19-10-11-20-8-5-9-21-12-15(17,14(16)18)13-6-3-2-4-7-13/h2-4,6-7H,5,8-12,17H2,1H3,(H2,16,18).
What are the key properties of 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide?
2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide has a molecular weight of 296.37 g/mol, XLogP of 0.40, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide is sourced from PubChem (CID 103404950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).