N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide

C15H25N3O — CID 60648364

IUPACN-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1ccc(N(CC)CC)cc1
InChIInChI=1S/C15H25N3O/c1-4-11-16-12-15(19)17-13-7-9-14(10-8-13)18(5-2)6-3/h7-10,16H,4-6,11-12H2,1-3H3,(H,17,19)
InChIKeyWJCDAOXBIWVZAN-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.47
Rot. Bonds8

About N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide

N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide (PubChem CID 60648364) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
PubChem CID60648364
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1ccc(N(CC)CC)cc1
InChIInChI=1S/C15H25N3O/c1-4-11-16-12-15(19)17-13-7-9-14(10-8-13)18(5-2)6-3/h7-10,16H,4-6,11-12H2,1-3H3,(H,17,19)
InChIKeyWJCDAOXBIWVZAN-UHFFFAOYSA-N
XLogP2.47
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
CID 60641172
N-[4-[[2-(propylamino)acetyl]amino]phenyl]propanamide
CID 54818859
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
N-(4-fluorophenyl)-2-(propylamino)acetamide
CID 28586343
N-(4-acetamidophenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108956266
N-[4-(diethylamino)phenyl]-2-(propylsulfonylamino)acetamide
CID 113000142
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
2-(propylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 60648393
2-[4-(diethylamino)anilino]-N-phenylacetamide
CID 70365941
3-[4-(diethylamino)anilino]-3-oxopropanoic acid
CID 62230045
N-(4-tert-butylphenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108954726
N-[4-(diethylamino)phenyl]-2-isocyanoacetamide
CID 108814829

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide (CID 60648364) is N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide is CCCNCC(=O)Nc1ccc(N(CC)CC)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide?
The InChIKey is WJCDAOXBIWVZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-11-16-12-15(19)17-13-7-9-14(10-8-13)18(5-2)6-3/h7-10,16H,4-6,11-12H2,1-3H3,(H,17,19).
What are the key properties of N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide?
N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.47, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide is sourced from PubChem (CID 60648364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).