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

C22H32N2O2 — CID 83282969

IUPAC3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc2c(C(CC(=O)NCCOC)C3CCCCC3)c[nH]c12
InChIInChI=1S/C22H32N2O2/c1-3-16-10-7-11-18-20(15-24-22(16)18)19(17-8-5-4-6-9-17)14-21(25)23-12-13-26-2/h7,10-11,15,17,19,24H,3-6,8-9,12-14H2,1-2H3,(H,23,25)
InChIKeyJECJLMWRODGYEJ-UHFFFAOYSA-N
MW356.51 g/mol
LogP4.55
Rot. Bonds8

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

3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide (PubChem CID 83282969) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
PubChem CID83282969
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC Name3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc2c(C(CC(=O)NCCOC)C3CCCCC3)c[nH]c12
InChIInChI=1S/C22H32N2O2/c1-3-16-10-7-11-18-20(15-24-22(16)18)19(17-8-5-4-6-9-17)14-21(25)23-12-13-26-2/h7,10-11,15,17,19,24H,3-6,8-9,12-14H2,1-2H3,(H,23,25)
InChIKeyJECJLMWRODGYEJ-UHFFFAOYSA-N
XLogP4.55
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide
CID 42808770
cyclohexyl-(7-ethyl-1H-indol-3-yl)methanamine
CID 82277764
3-(2-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(3-methoxypropyl)propanamide
CID 42803855
3-(7-ethyl-1H-indol-3-yl)-N-(3-methoxypropyl)-3-(3-nitrophenyl)propanamide
CID 42803805
3-cyclohexyl-3-(7-methoxy-1H-indol-3-yl)-N-methylpropan-1-amine
CID 58088422
N-cyclopropyl-3-(7-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)propanamide
CID 3428544
(3S)-3-(2,3-dimethoxyphenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 93125176
3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-piperidin-1-ylethyl)propanamide
CID 42804479
3-(7-ethyl-1H-indol-3-yl)-N-(2-methylpropyl)-3-phenylpropanamide
CID 4102874
(3R)-3-(2,3-dimethoxyphenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 93125185
3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-hexylpropanamide
CID 42802283
3-(7-ethyl-1H-indol-3-yl)-N-[3-(2-methylpiperidin-1-yl)propyl]-3-[3-(trifluoromethyl)phenyl]propanamide
CID 24718657

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide (CID 83282969) is 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide is CCc1cccc2c(C(CC(=O)NCCOC)C3CCCCC3)c[nH]c12.
What is the InChIKey of 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
The InChIKey is JECJLMWRODGYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O2/c1-3-16-10-7-11-18-20(15-24-22(16)18)19(17-8-5-4-6-9-17)14-21(25)23-12-13-26-2/h7,10-11,15,17,19,24H,3-6,8-9,12-14H2,1-2H3,(H,23,25).
What are the key properties of 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide?
3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide has a molecular weight of 356.51 g/mol, XLogP of 4.55, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 83282969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).