N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide

C26H33N3O3 — CID 55913285

IUPACN-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cn(CC(C)C)c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C26H33N3O3/c1-19(2)17-29-18-23(22-6-4-5-7-24(22)29)26(30)27-16-25(28-12-14-32-15-13-28)20-8-10-21(31-3)11-9-20/h4-11,18-19,25H,12-17H2,1-3H3,(H,27,30)
InChIKeyGOUPUSSDEJLBMP-UHFFFAOYSA-N
MW435.57 g/mol
LogP4.11
Rot. Bonds8

About N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide

N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide (PubChem CID 55913285) has the molecular formula C26H33N3O3 and a molecular weight of 435.57 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide
PubChem CID55913285
Molecular FormulaC26H33N3O3
Molecular Weight435.57 g/mol
Exact Mass435.25
IUPAC NameN-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cn(CC(C)C)c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C26H33N3O3/c1-19(2)17-29-18-23(22-6-4-5-7-24(22)29)26(30)27-16-25(28-12-14-32-15-13-28)20-8-10-21(31-3)11-9-20/h4-11,18-19,25H,12-17H2,1-3H3,(H,27,30)
InChIKeyGOUPUSSDEJLBMP-UHFFFAOYSA-N
XLogP4.11
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.57
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide
CID 31909519
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-1-methylindole-3-carboxamide
CID 29223882
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,5-dimethylfuran-3-carboxamide
CID 2998590
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 25467103
N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 25467101
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
2-(2-cyanophenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17438662
2-ethoxy-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]naphthalene-1-carboxamide
CID 16813209
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide
CID 55331292
4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460518
4-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011129

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide?
The IUPAC name of N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide (CID 55913285) is N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide is COc1ccc(C(CNC(=O)c2cn(CC(C)C)c3ccccc23)N2CCOCC2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide?
The InChIKey is GOUPUSSDEJLBMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N3O3/c1-19(2)17-29-18-23(22-6-4-5-7-24(22)29)26(30)27-16-25(28-12-14-32-15-13-28)20-8-10-21(31-3)11-9-20/h4-11,18-19,25H,12-17H2,1-3H3,(H,27,30).
What are the key properties of N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide?
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide has a molecular weight of 435.57 g/mol, XLogP of 4.11, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide is sourced from PubChem (CID 55913285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).