3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide

C23H32ClN3O2 — CID 83289116

IUPAC3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CC(c1c[nH]c2ccc(Cl)cc12)C1CCCCC1)NCCN1CCOCC1
InChIInChI=1S/C23H32ClN3O2/c24-18-6-7-22-20(14-18)21(16-26-22)19(17-4-2-1-3-5-17)15-23(28)25-8-9-27-10-12-29-13-11-27/h6-7,14,16-17,19,26H,1-5,8-13,15H2,(H,25,28)
InChIKeyFCQDPANCCLRLJR-UHFFFAOYSA-N
MW417.98 g/mol
LogP4.32
Rot. Bonds7

About 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide

3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 83289116) has the molecular formula C23H32ClN3O2 and a molecular weight of 417.98 g/mol. Its IUPAC name is 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID83289116
Molecular FormulaC23H32ClN3O2
Molecular Weight417.98 g/mol
Exact Mass417.22
IUPAC Name3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CC(c1c[nH]c2ccc(Cl)cc12)C1CCCCC1)NCCN1CCOCC1
InChIInChI=1S/C23H32ClN3O2/c24-18-6-7-22-20(14-18)21(16-26-22)19(17-4-2-1-3-5-17)15-23(28)25-8-9-27-10-12-29-13-11-27/h6-7,14,16-17,19,26H,1-5,8-13,15H2,(H,25,28)
InChIKeyFCQDPANCCLRLJR-UHFFFAOYSA-N
XLogP4.32
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.98
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide (CID 83289116) is 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide is O=C(CC(c1c[nH]c2ccc(Cl)cc12)C1CCCCC1)NCCN1CCOCC1.
What is the InChIKey of 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is FCQDPANCCLRLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32ClN3O2/c24-18-6-7-22-20(14-18)21(16-26-22)19(17-4-2-1-3-5-17)15-23(28)25-8-9-27-10-12-29-13-11-27/h6-7,14,16-17,19,26H,1-5,8-13,15H2,(H,25,28).
What are the key properties of 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide?
3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 417.98 g/mol, XLogP of 4.32, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-1H-indol-3-yl)-3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 83289116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).