N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide

C22H24N2O4 — CID 113085260

IUPACN-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc2[nH]cc(C3(CNC(=O)COc4ccccc4OC)CC3)c2c1
InChIInChI=1S/C22H24N2O4/c1-26-15-7-8-18-16(11-15)17(12-23-18)22(9-10-22)14-24-21(25)13-28-20-6-4-3-5-19(20)27-2/h3-8,11-12,23H,9-10,13-14H2,1-2H3,(H,24,25)
InChIKeyZODBLLOXCSHIBX-UHFFFAOYSA-N
MW380.44 g/mol
LogP3.41
Rot. Bonds8

About N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide

N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 113085260) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID113085260
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC NameN-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc2[nH]cc(C3(CNC(=O)COc4ccccc4OC)CC3)c2c1
InChIInChI=1S/C22H24N2O4/c1-26-15-7-8-18-16(11-15)17(12-23-18)22(9-10-22)14-24-21(25)13-28-20-6-4-3-5-19(20)27-2/h3-8,11-12,23H,9-10,13-14H2,1-2H3,(H,24,25)
InChIKeyZODBLLOXCSHIBX-UHFFFAOYSA-N
XLogP3.41
TPSA72.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethoxy-N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]benzamide
CID 113085241
N-[[1-(5-chloro-1H-indol-3-yl)cyclopropyl]methyl]-2-(4-methylphenoxy)acetamide
CID 113085166
N-(1H-indol-3-ylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 110357480
2-(2-methoxyphenoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 18128274
N-[2-(1H-indol-3-yl)ethyl]-1-(5-methoxy-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113210779
N-[[1-(5-fluoro-1H-indol-3-yl)cyclopropyl]methyl]propanamide
CID 113085017
N-[[1-(5-chloro-1H-indol-3-yl)cyclopropyl]methyl]-3-phenoxypropanamide
CID 113085158
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 71826977
N-(2,5-dimethoxyphenyl)-1-(5-methoxy-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113210851
N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]butanamide
CID 113084659
N-[[1-(6-fluoro-1H-indol-3-yl)cyclopropyl]methyl]-2-methoxybenzamide
CID 113085331
N-[[1-(dimethylamino)cyclohexyl]methyl]-2-(2-methoxyphenoxy)acetamide;hydrochloride
CID 20995004

Frequently Asked Questions

What is the IUPAC name of N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide (CID 113085260) is N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide is COc1ccc2[nH]cc(C3(CNC(=O)COc4ccccc4OC)CC3)c2c1.
What is the InChIKey of N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is ZODBLLOXCSHIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-26-15-7-8-18-16(11-15)17(12-23-18)22(9-10-22)14-24-21(25)13-28-20-6-4-3-5-19(20)27-2/h3-8,11-12,23H,9-10,13-14H2,1-2H3,(H,24,25).
What are the key properties of N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide?
N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 380.44 g/mol, XLogP of 3.41, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(5-methoxy-1H-indol-3-yl)cyclopropyl]methyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 113085260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).