3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide

C22H25ClN2O2 — CID 42808770

IUPAC3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc2c(C(CC(=O)NCCOC)c3ccc(Cl)cc3)c[nH]c12
InChIInChI=1S/C22H25ClN2O2/c1-3-15-5-4-6-18-20(14-25-22(15)18)19(13-21(26)24-11-12-27-2)16-7-9-17(23)10-8-16/h4-10,14,19,25H,3,11-13H2,1-2H3,(H,24,26)
InChIKeyKQQKWLKVMJCRIZ-UHFFFAOYSA-N
MW384.91 g/mol
LogP4.67
Rot. Bonds8

About 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide

3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide (PubChem CID 42808770) has the molecular formula C22H25ClN2O2 and a molecular weight of 384.91 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
PubChem CID42808770
Molecular FormulaC22H25ClN2O2
Molecular Weight384.91 g/mol
Exact Mass384.16
IUPAC Name3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc2c(C(CC(=O)NCCOC)c3ccc(Cl)cc3)c[nH]c12
InChIInChI=1S/C22H25ClN2O2/c1-3-15-5-4-6-18-20(14-25-22(15)18)19(13-21(26)24-11-12-27-2)16-7-9-17(23)10-8-16/h4-10,14,19,25H,3,11-13H2,1-2H3,(H,24,26)
InChIKeyKQQKWLKVMJCRIZ-UHFFFAOYSA-N
XLogP4.67
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.91
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide 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

3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-hexylpropanamide
CID 42802283
(3R)-3-(4-chlorophenyl)-N-[2-(2,4-dichlorophenyl)ethyl]-3-(7-ethyl-1H-indol-3-yl)propanamide
CID 93122197
3-(2-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(3-methoxypropyl)propanamide
CID 42803855
3-(3-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-propylpropanamide
CID 42774598
3-(7-ethyl-1H-indol-3-yl)-N-(3-methoxypropyl)-3-(3-nitrophenyl)propanamide
CID 42803805
3-(3,4-dichlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-phenylethyl)propanamide
CID 24718694
(3R)-3-(3,4-dichlorophenyl)-N-[2-(dimethylamino)ethyl]-3-(7-ethyl-1H-indol-3-yl)propanamide
CID 93123792
3-(7-ethyl-1H-indol-3-yl)-N-(2-methylpropyl)-3-phenylpropanamide
CID 4102874
3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
CID 83282969
(3S)-3-(4-chlorophenyl)-N-[(2S)-5-(diethylamino)pentan-2-yl]-3-(7-ethyl-1H-indol-3-yl)propanamide
CID 93122210
(3S)-3-(3,4-dichlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(7-ethyl-1H-indol-3-yl)propanamide
CID 93123771
3-(4-ethoxyphenyl)-3-(1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
CID 91634966

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide (CID 42808770) is 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide is CCc1cccc2c(C(CC(=O)NCCOC)c3ccc(Cl)cc3)c[nH]c12.
What is the InChIKey of 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The InChIKey is KQQKWLKVMJCRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN2O2/c1-3-15-5-4-6-18-20(14-25-22(15)18)19(13-21(26)24-11-12-27-2)16-7-9-17(23)10-8-16/h4-10,14,19,25H,3,11-13H2,1-2H3,(H,24,26).
What are the key properties of 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide has a molecular weight of 384.91 g/mol, XLogP of 4.67, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 42808770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).