2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide

C14H21N3O3 — CID 115574236

IUPAC2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide
SMILESCOCCNC(=O)CNC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C14H21N3O3/c1-11(16-10-13(18)15-8-9-20-2)14(19)17-12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3,(H,15,18)(H,17,19)
InChIKeyPXJRVYHDDYIDCK-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.37
Rot. Bonds8

About 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide

2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide (PubChem CID 115574236) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide
PubChem CID115574236
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide
SMILESCOCCNC(=O)CNC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C14H21N3O3/c1-11(16-10-13(18)15-8-9-20-2)14(19)17-12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3,(H,15,18)(H,17,19)
InChIKeyPXJRVYHDDYIDCK-UHFFFAOYSA-N
XLogP0.37
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-(2-methoxyethylamino)acetyl]amino]-N-phenylpropanamide;hydrochloride
CID 119785054
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide
CID 43401445
N'-(2-methoxyethyl)-3-methyl-N-phenylpentanediamide
CID 3607807
N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide
CID 54830793
N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]-2,2-diphenylacetamide
CID 39231113
2-[2-[2-methoxyethyl(methyl)amino]ethylamino]-N-phenylpropanamide
CID 62842763
2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-prop-2-enylpropanamide
CID 113219588
N-butyl-2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanamide
CID 112683886
N-(2-methoxyethyl)-2-(1-phenylpropylamino)acetamide
CID 54845797
3-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]-2-methyl-3-phenylpropanamide
CID 115738057
(2R)-2-[[2-(methylamino)-2-oxoethyl]amino]-N-(4-phenoxyphenyl)propanamide
CID 8771908
N-(2-methoxyethyl)-2-[1-(2-methylphenyl)ethylamino]acetamide
CID 60641541

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide?
The IUPAC name of 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide (CID 115574236) is 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide.
What is the SMILES notation for 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide?
The canonical SMILES for 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide is COCCNC(=O)CNC(C)C(=O)Nc1ccccc1.
What is the InChIKey of 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide?
The InChIKey is PXJRVYHDDYIDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-11(16-10-13(18)15-8-9-20-2)14(19)17-12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3,(H,15,18)(H,17,19).
What are the key properties of 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide?
2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide has a molecular weight of 279.34 g/mol, XLogP of 0.37, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide is sourced from PubChem (CID 115574236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).