N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide

C16H18F3N3O2 — CID 154116724

IUPACN-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc2ccc(C(F)(F)F)cc2[nH]1
InChIInChI=1S/C16H18F3N3O2/c17-16(18,19)12-2-1-11-9-14(21-13(11)10-12)15(23)20-3-4-22-5-7-24-8-6-22/h1-2,9-10,21H,3-8H2,(H,20,23)
InChIKeyLAZARMYDXZLMFX-UHFFFAOYSA-N
MW341.33 g/mol
LogP2.25
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide

N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide (PubChem CID 154116724) has the molecular formula C16H18F3N3O2 and a molecular weight of 341.33 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide
PubChem CID154116724
Molecular FormulaC16H18F3N3O2
Molecular Weight341.33 g/mol
Exact Mass341.14
IUPAC NameN-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc2ccc(C(F)(F)F)cc2[nH]1
InChIInChI=1S/C16H18F3N3O2/c17-16(18,19)12-2-1-11-9-14(21-13(11)10-12)15(23)20-3-4-22-5-7-24-8-6-22/h1-2,9-10,21H,3-8H2,(H,20,23)
InChIKeyLAZARMYDXZLMFX-UHFFFAOYSA-N
XLogP2.25
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.33
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-morpholin-4-ylethylcarbamoyl)-1H-indole-2-carboxylic acid
CID 19608777
N-[1-methyl-5-[[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]-1H-indole-2-carboxamide
CID 10952359
N-(2-morpholin-4-ylethyl)-4-[4-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 10091411
N-(2-piperidin-1-ylethyl)-1H-indole-2-carboxamide
CID 2219273
N-(2-morpholin-4-ylethyl)-3-[5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]-1H-pyrazole-5-carboxamide
CID 136954220
4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide
CID 110332223
N-cyclohexyl-6-(trifluoromethyl)-1H-indole-2-carboxamide
CID 171354096
3-methyl-N-(3-morpholin-4-ylpropyl)-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzamide
CID 21101111
N-(2-morpholin-4-ylethyl)-2-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134799622
N-(2-morpholin-4-ylethyl)-2-oxo-4-phenyl-1H-pyrimidine-6-carboxamide
CID 110332072
[5-hydroxy-2-(2-morpholin-4-ylethylcarbamoyl)-1H-indol-4-yl] formate
CID 174680738
N-[2-[[4-(trifluoromethyl)benzoyl]amino]ethyl]-1H-indole-2-carboxamide
CID 34509270

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide (CID 154116724) is N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide is O=C(NCCN1CCOCC1)c1cc2ccc(C(F)(F)F)cc2[nH]1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide?
The InChIKey is LAZARMYDXZLMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F3N3O2/c17-16(18,19)12-2-1-11-9-14(21-13(11)10-12)15(23)20-3-4-22-5-7-24-8-6-22/h1-2,9-10,21H,3-8H2,(H,20,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide?
N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide has a molecular weight of 341.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 154116724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).