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

C22H25N3O3 — CID 31909519

IUPACN-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide
SMILESCOc1ccc([C@H](CNC(=O)c2c[nH]c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C22H25N3O3/c1-27-17-8-6-16(7-9-17)21(25-10-12-28-13-11-25)15-24-22(26)19-14-23-20-5-3-2-4-18(19)20/h2-9,14,21,23H,10-13,15H2,1H3,(H,24,26)/t21-/m0/s1
InChIKeyCEHSNNAVICIMPB-NRFANRHFSA-N
MW379.46 g/mol
LogP2.98
Rot. Bonds6

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

N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide (PubChem CID 31909519) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide
PubChem CID31909519
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC NameN-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide
SMILESCOc1ccc([C@H](CNC(=O)c2c[nH]c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C22H25N3O3/c1-27-17-8-6-16(7-9-17)21(25-10-12-28-13-11-25)15-24-22(26)19-14-23-20-5-3-2-4-18(19)20/h2-9,14,21,23H,10-13,15H2,1H3,(H,24,26)/t21-/m0/s1
InChIKeyCEHSNNAVICIMPB-NRFANRHFSA-N
XLogP2.98
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropyl)indole-3-carboxamide
CID 55913285
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,5-dimethylfuran-3-carboxamide
CID 2998590
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 30834690
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-2-(1H-indol-3-yl)acetamide
CID 46517704
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 30834692
1-[3-(1H-indol-3-yl)propyl]-3-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-methylguanidine;hydroiodide
CID 111753330
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide
CID 55331292
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

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide?
The IUPAC name of N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide (CID 31909519) is N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide?
The canonical SMILES for N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide is COc1ccc([C@H](CNC(=O)c2c[nH]c3ccccc23)N2CCOCC2)cc1.
What is the InChIKey of N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide?
The InChIKey is CEHSNNAVICIMPB-NRFANRHFSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-27-17-8-6-16(7-9-17)21(25-10-12-28-13-11-25)15-24-22(26)19-14-23-20-5-3-2-4-18(19)20/h2-9,14,21,23H,10-13,15H2,1H3,(H,24,26)/t21-/m0/s1.
What are the key properties of N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide?
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 2.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1H-indole-3-carboxamide is sourced from PubChem (CID 31909519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).