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

C22H32N4O — CID 109010373

IUPAC2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
SMILESCCN(CC)c1ccc(NCC(=O)Nc2ccc(N(CC)CC)cc2)cc1
InChIInChI=1S/C22H32N4O/c1-5-25(6-2)20-13-9-18(10-14-20)23-17-22(27)24-19-11-15-21(16-12-19)26(7-3)8-4/h9-16,23H,5-8,17H2,1-4H3,(H,24,27)
InChIKeyCHCOBYOZWFHLIO-UHFFFAOYSA-N
MW368.53 g/mol
LogP4.43
Rot. Bonds10

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

2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide (PubChem CID 109010373) has the molecular formula C22H32N4O and a molecular weight of 368.53 g/mol. Its IUPAC name is 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
PubChem CID109010373
Molecular FormulaC22H32N4O
Molecular Weight368.53 g/mol
Exact Mass368.26
IUPAC Name2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
SMILESCCN(CC)c1ccc(NCC(=O)Nc2ccc(N(CC)CC)cc2)cc1
InChIInChI=1S/C22H32N4O/c1-5-25(6-2)20-13-9-18(10-14-20)23-17-22(27)24-19-11-15-21(16-12-19)26(7-3)8-4/h9-16,23H,5-8,17H2,1-4H3,(H,24,27)
InChIKeyCHCOBYOZWFHLIO-UHFFFAOYSA-N
XLogP4.43
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.53
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(diethylamino)anilino]-N-phenylacetamide
CID 70365941
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
2-[4-(diethylamino)anilino]-N-(2-methylphenyl)acetamide
CID 109007146
N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
CID 60641172
2-[4-(diethylamino)anilino]acetic acid;dihydrochloride
CID 131880910
2-[4-(diethylamino)anilino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109010414
2-[4-(diethylamino)anilino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 109007808
N-(3-chloro-4-methoxyphenyl)-2-[4-(diethylamino)anilino]acetamide
CID 109008840
N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
CID 60648364
N-(2,3-dichlorophenyl)-2-[4-(diethylamino)anilino]acetamide
CID 109010402
3-[4-(diethylamino)anilino]-3-oxopropanoic acid
CID 62230045
N-(4-acetamidophenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108956266

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide?
The IUPAC name of 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide (CID 109010373) is 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide.
What is the SMILES notation for 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide?
The canonical SMILES for 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide is CCN(CC)c1ccc(NCC(=O)Nc2ccc(N(CC)CC)cc2)cc1.
What is the InChIKey of 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide?
The InChIKey is CHCOBYOZWFHLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O/c1-5-25(6-2)20-13-9-18(10-14-20)23-17-22(27)24-19-11-15-21(16-12-19)26(7-3)8-4/h9-16,23H,5-8,17H2,1-4H3,(H,24,27).
What are the key properties of 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide?
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide has a molecular weight of 368.53 g/mol, XLogP of 4.43, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide is sourced from PubChem (CID 109010373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).