N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide

C20H26N2O — CID 19167686

IUPACN-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide
SMILESCCN(CC)c1ccc(NC(=O)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C20H26N2O/c1-6-22(7-2)18-10-8-17(9-11-18)21-20(23)19-15(4)12-14(3)13-16(19)5/h8-13H,6-7H2,1-5H3,(H,21,23)
InChIKeyMEOAIIIHUIWUBV-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.71
Rot. Bonds5

About N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide

N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide (PubChem CID 19167686) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide
PubChem CID19167686
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC NameN-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide
SMILESCCN(CC)c1ccc(NC(=O)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C20H26N2O/c1-6-22(7-2)18-10-8-17(9-11-18)21-20(23)19-15(4)12-14(3)13-16(19)5/h8-13H,6-7H2,1-5H3,(H,21,23)
InChIKeyMEOAIIIHUIWUBV-UHFFFAOYSA-N
XLogP4.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(diethylcarbamoyl)phenyl]-2,4,6-trimethylbenzamide
CID 112793726
N-[4-(diethylamino)phenyl]-N'-(2,4,6-trimethylphenyl)propanediamide
CID 108954456
N-[4-(diethylamino)phenyl]-3-methylbenzamide
CID 835431
N-[4-(diethylamino)phenyl]-2-hydroxy-5-methylbenzamide
CID 39122388
3-amino-N-[4-(diethylamino)phenyl]-4-methylbenzamide
CID 28723656
1-N-[4-(diethylamino)phenyl]-1-N'-(2,4,6-trimethylphenyl)cyclopropane-1,1-dicarboxamide
CID 108982110
[2-[2-[4-(diethylamino)benzoyl]hydrazinyl]-2-oxoethyl] 2,4,6-trimethylbenzoate
CID 7434489
1-[4-(diethylamino)phenyl]-3-(3-methylphenyl)urea
CID 71323967
N-[4-(diethylamino)phenyl]-3,5-dimethoxy-4-methylbenzamide
CID 2665776
N-[4-(diethylamino)phenyl]-2-iodo-3-methylbenzamide
CID 55685027
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide (CID 19167686) is N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide is CCN(CC)c1ccc(NC(=O)c2c(C)cc(C)cc2C)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide?
The InChIKey is MEOAIIIHUIWUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-6-22(7-2)18-10-8-17(9-11-18)21-20(23)19-15(4)12-14(3)13-16(19)5/h8-13H,6-7H2,1-5H3,(H,21,23).
What are the key properties of N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide?
N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide has a molecular weight of 310.44 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide is sourced from PubChem (CID 19167686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).