N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide

C13H19N3O4 — CID 79281170

IUPACN-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(OCC(N)=O)cc1
InChIInChI=1S/C13H19N3O4/c1-19-7-6-15-8-13(18)16-10-2-4-11(5-3-10)20-9-12(14)17/h2-5,15H,6-9H2,1H3,(H2,14,17)(H,16,18)
InChIKeyCINDIHNYFUQKOV-UHFFFAOYSA-N
MW281.31 g/mol
LogP-0.27
Rot. Bonds9

About N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide

N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 79281170) has the molecular formula C13H19N3O4 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
PubChem CID79281170
Molecular FormulaC13H19N3O4
Molecular Weight281.31 g/mol
Exact Mass281.14
IUPAC NameN-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(OCC(N)=O)cc1
InChIInChI=1S/C13H19N3O4/c1-19-7-6-15-8-13(18)16-10-2-4-11(5-3-10)20-9-12(14)17/h2-5,15H,6-9H2,1H3,(H2,14,17)(H,16,18)
InChIKeyCINDIHNYFUQKOV-UHFFFAOYSA-N
XLogP-0.27
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
2-[4-[(2-methoxyacetyl)amino]phenoxy]acetamide
CID 47156560
2-(2-methoxyethylamino)-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54819703
N-(4-iodophenyl)-2-(2-methoxyethylamino)acetamide
CID 54819702
N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
CID 119738642
N-[4-(difluoromethoxy)phenyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119676558
N-[4-(3,5-dimethylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119741341
2-(hexadecylamino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54808989
2-chloro-5-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
CID 79281641
N-[4-[[2-(2-methoxyethylamino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54819837
ethyl 4-[[2-(2-methoxyethylamino)acetyl]amino]benzoate;hydrochloride
CID 119672462
2-[3-[[2-(2-methoxyethylamino)acetyl]amino]phenoxy]acetic acid
CID 79282011

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide (CID 79281170) is N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide is COCCNCC(=O)Nc1ccc(OCC(N)=O)cc1.
What is the InChIKey of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is CINDIHNYFUQKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O4/c1-19-7-6-15-8-13(18)16-10-2-4-11(5-3-10)20-9-12(14)17/h2-5,15H,6-9H2,1H3,(H2,14,17)(H,16,18).
What are the key properties of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 281.31 g/mol, XLogP of -0.27, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 79281170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).