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

C14H23N3O — CID 60641172

IUPACN-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
SMILESCCNCC(=O)Nc1ccc(N(CC)CC)cc1
InChIInChI=1S/C14H23N3O/c1-4-15-11-14(18)16-12-7-9-13(10-8-12)17(5-2)6-3/h7-10,15H,4-6,11H2,1-3H3,(H,16,18)
InChIKeyBHISQNFNUQBXFN-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.08
Rot. Bonds7

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

N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide (PubChem CID 60641172) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
PubChem CID60641172
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
SMILESCCNCC(=O)Nc1ccc(N(CC)CC)cc1
InChIInChI=1S/C14H23N3O/c1-4-15-11-14(18)16-12-7-9-13(10-8-12)17(5-2)6-3/h7-10,15H,4-6,11H2,1-3H3,(H,16,18)
InChIKeyBHISQNFNUQBXFN-UHFFFAOYSA-N
XLogP2.08
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
CID 60648364
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
2-[4-(diethylamino)anilino]-N-phenylacetamide
CID 70365941
N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
CID 54820671
3-[4-(diethylamino)anilino]-3-oxopropanoic acid
CID 62230045
N-(4-acetamidophenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108956266
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
N-[4-(diethylamino)phenyl]-2-(propylsulfonylamino)acetamide
CID 113000142
2-(1,3-benzodioxol-5-ylmethylamino)-N-[4-(diethylamino)phenyl]acetamide
CID 108998771
4-[4-(diethylamino)anilino]-4-oxobutanoic acid
CID 722023
2-(ethylamino)-N-(4-methoxyphenyl)acetamide
CID 2113294
N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide
CID 54820940

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide (CID 60641172) is N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide is CCNCC(=O)Nc1ccc(N(CC)CC)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide?
The InChIKey is BHISQNFNUQBXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-15-11-14(18)16-12-7-9-13(10-8-12)17(5-2)6-3/h7-10,15H,4-6,11H2,1-3H3,(H,16,18).
What are the key properties of N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide?
N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide has a molecular weight of 249.36 g/mol, XLogP of 2.08, 7 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-(ethylamino)acetamide is sourced from PubChem (CID 60641172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).