N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide

C15H23N3O3 — CID 54830793

IUPACN-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide
SMILESCOCCNC(=O)CNc1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C15H23N3O3/c1-11(2)15(20)18-13-6-4-12(5-7-13)17-10-14(19)16-8-9-21-3/h4-7,11,17H,8-10H2,1-3H3,(H,16,19)(H,18,20)
InChIKeyZQLVCFUPSUTJFD-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.46
Rot. Bonds8

About N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide

N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide (PubChem CID 54830793) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide
PubChem CID54830793
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide
SMILESCOCCNC(=O)CNc1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C15H23N3O3/c1-11(2)15(20)18-13-6-4-12(5-7-13)17-10-14(19)16-8-9-21-3/h4-7,11,17H,8-10H2,1-3H3,(H,16,19)(H,18,20)
InChIKeyZQLVCFUPSUTJFD-UHFFFAOYSA-N
XLogP1.46
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.46
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-(4-chloroanilino)-N-(2-methoxyethyl)acetamide
CID 39347241
N-(2-methoxyethyl)-2-[4-(3-methylbutoxy)anilino]acetamide
CID 54821761
N-[4-[(2-methoxyethylcarbamoylamino)methyl]phenyl]-2-methylpropanamide
CID 38154617
2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-phenylpropanamide
CID 115574236
4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-propylbenzamide
CID 54835797
N-[4-[(2-anilino-2-oxoethyl)amino]phenyl]-2-methylpropanamide
CID 54830466
N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
CID 54833942
4-[[2-(4-acetamidoanilino)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836640
2-(3-chloroanilino)-N-(2-methoxyethyl)acetamide
CID 39347237
4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N,N-dipropylbenzamide
CID 54831987
2-methyl-N-[4-[[2-oxo-2-[4-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]propanamide
CID 54830534
N-[4-[2-(2-methoxyethylamino)-2-oxoethyl]phenyl]-2,2-diphenylacetamide
CID 39231113

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide?
The IUPAC name of N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide (CID 54830793) is N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide is COCCNC(=O)CNc1ccc(NC(=O)C(C)C)cc1.
What is the InChIKey of N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide?
The InChIKey is ZQLVCFUPSUTJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11(2)15(20)18-13-6-4-12(5-7-13)17-10-14(19)16-8-9-21-3/h4-7,11,17H,8-10H2,1-3H3,(H,16,19)(H,18,20).
What are the key properties of N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide?
N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide has a molecular weight of 293.37 g/mol, XLogP of 1.46, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide is sourced from PubChem (CID 54830793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).