N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide

C23H29NO5 — CID 71540279

IUPACN-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(CC(=O)NC2CCCC2)c2c(O)cc(OC)cc2OC)cc1
InChIInChI=1S/C23H29NO5/c1-27-17-10-8-15(9-11-17)19(14-22(26)24-16-6-4-5-7-16)23-20(25)12-18(28-2)13-21(23)29-3/h8-13,16,19,25H,4-7,14H2,1-3H3,(H,24,26)
InChIKeyYHYJVUMMAZLUEF-UHFFFAOYSA-N
MW399.49 g/mol
LogP4.00
Rot. Bonds8

About N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide

N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide (PubChem CID 71540279) has the molecular formula C23H29NO5 and a molecular weight of 399.49 g/mol. Its IUPAC name is N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide
PubChem CID71540279
Molecular FormulaC23H29NO5
Molecular Weight399.49 g/mol
Exact Mass399.20
IUPAC NameN-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(CC(=O)NC2CCCC2)c2c(O)cc(OC)cc2OC)cc1
InChIInChI=1S/C23H29NO5/c1-27-17-10-8-15(9-11-17)19(14-22(26)24-16-6-4-5-7-16)23-20(25)12-18(28-2)13-21(23)29-3/h8-13,16,19,25H,4-7,14H2,1-3H3,(H,24,26)
InChIKeyYHYJVUMMAZLUEF-UHFFFAOYSA-N
XLogP4.00
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.49
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)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 N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide (CID 71540279) is N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide is COc1ccc(C(CC(=O)NC2CCCC2)c2c(O)cc(OC)cc2OC)cc1.
What is the InChIKey of N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is YHYJVUMMAZLUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO5/c1-27-17-10-8-15(9-11-17)19(14-22(26)24-16-6-4-5-7-16)23-20(25)12-18(28-2)13-21(23)29-3/h8-13,16,19,25H,4-7,14H2,1-3H3,(H,24,26).
What are the key properties of N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 399.49 g/mol, XLogP of 4.00, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 71540279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).