N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide

C23H29N3O — CID 113211503

IUPACN-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2c(C)n(C)c3ccccc23)c(C)c1
InChIInChI=1S/C23H29N3O/c1-6-26(7-2)18-12-13-21(16(3)14-18)24-23(27)15-20-17(4)25(5)22-11-9-8-10-19(20)22/h8-14H,6-7,15H2,1-5H3,(H,24,27)
InChIKeyCROJEIYPDNCGPP-UHFFFAOYSA-N
MW363.51 g/mol
LogP4.82
Rot. Bonds6

About N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide

N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide (PubChem CID 113211503) has the molecular formula C23H29N3O and a molecular weight of 363.51 g/mol. Its IUPAC name is N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide
PubChem CID113211503
Molecular FormulaC23H29N3O
Molecular Weight363.51 g/mol
Exact Mass363.23
IUPAC NameN-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2c(C)n(C)c3ccccc23)c(C)c1
InChIInChI=1S/C23H29N3O/c1-6-26(7-2)18-12-13-21(16(3)14-18)24-23(27)15-20-17(4)25(5)22-11-9-8-10-19(20)22/h8-14H,6-7,15H2,1-5H3,(H,24,27)
InChIKeyCROJEIYPDNCGPP-UHFFFAOYSA-N
XLogP4.82
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.51
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide 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-(2-bromophenyl)-2-(1,2-dimethylindol-3-yl)acetamide
CID 113211482
N-[4-(diethylamino)-2-methylphenyl]butanamide
CID 837078
N-[4-(diethylamino)-2-methylphenyl]-N'-(2-ethylphenyl)propanediamide
CID 108953999
1-acetyl-N-[4-(diethylamino)-2-methylphenyl]indole-3-carboxamide
CID 113208003
N-[4-(diethylamino)-2-methylphenyl]-2-[2-(1H-indol-3-yl)ethylamino]acetamide
CID 109002411
N-(4-acetamidophenyl)-2-(1,2-dimethylindol-3-yl)acetamide
CID 110768882
N-(3,5-dichlorophenyl)-2-(1,2-dimethylindol-3-yl)acetamide
CID 113211498
N-[4-(diethylamino)-2-methylphenyl]-2-[(2-fluorophenyl)methylamino]acetamide
CID 108997613
2-(1,2-dimethylindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110768894
N-[4-(diethylamino)-2-methylphenyl]-N',N'-diethylpropanediamide
CID 108951161
N-[4-(diethylamino)-2-methylphenyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 44753800
N-[4-(diethylamino)-2-methylphenyl]-3-[(2-methylphenyl)methylamino]propanamide
CID 109019401

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide?
The IUPAC name of N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide (CID 113211503) is N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide.
What is the SMILES notation for N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide?
The canonical SMILES for N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide is CCN(CC)c1ccc(NC(=O)Cc2c(C)n(C)c3ccccc23)c(C)c1.
What is the InChIKey of N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide?
The InChIKey is CROJEIYPDNCGPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O/c1-6-26(7-2)18-12-13-21(16(3)14-18)24-23(27)15-20-17(4)25(5)22-11-9-8-10-19(20)22/h8-14H,6-7,15H2,1-5H3,(H,24,27).
What are the key properties of N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide?
N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide has a molecular weight of 363.51 g/mol, XLogP of 4.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)-2-methylphenyl]-2-(1,2-dimethylindol-3-yl)acetamide is sourced from PubChem (CID 113211503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).