N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide

C17H23N3O2 — CID 56704628

IUPACN-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide
SMILESCCN1CCOC(CCNC(=O)c2c[nH]c3ccccc23)C1
InChIInChI=1S/C17H23N3O2/c1-2-20-9-10-22-13(12-20)7-8-18-17(21)15-11-19-16-6-4-3-5-14(15)16/h3-6,11,13,19H,2,7-10,12H2,1H3,(H,18,21)
InChIKeyVNJJUVCJWVZVAF-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.01
Rot. Bonds5

About N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide

N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide (PubChem CID 56704628) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide
PubChem CID56704628
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide
SMILESCCN1CCOC(CCNC(=O)c2c[nH]c3ccccc23)C1
InChIInChI=1S/C17H23N3O2/c1-2-20-9-10-22-13(12-20)7-8-18-17(21)15-11-19-16-6-4-3-5-14(15)16/h3-6,11,13,19H,2,7-10,12H2,1H3,(H,18,21)
InChIKeyVNJJUVCJWVZVAF-UHFFFAOYSA-N
XLogP2.01
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-ethylmorpholin-2-yl)ethyl]-3-oxo-4H-quinoxaline-2-carboxamide
CID 56702354
N-[2-(4-ethylmorpholin-2-yl)ethyl]-2-oxochromene-3-carboxamide
CID 56717531
N-(2-cyclopentylethyl)-1H-indole-3-carboxamide
CID 47267271
N-[(4-ethylmorpholin-2-yl)methyl]-3-hydroxy-2-methylbenzamide
CID 115869037
6-amino-N-[2-(oxolan-2-yl)ethyl]-1H-indole-3-carboxamide
CID 61126926
N-(3-ethoxypropyl)-1H-indole-3-carboxamide
CID 17474567
2-hydroxy-4-(1H-indole-3-carbonylamino)butanoic acid
CID 107831836
N-(3-methylsulfinylbutyl)-1H-indole-3-carboxamide
CID 115729499
N-[2-[(2S)-4-ethylmorpholin-2-yl]ethyl]-2-methyl-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide
CID 95201404
1-methyl-N-[2-[4-(3-methylbut-2-enyl)morpholin-2-yl]ethyl]-2-oxopyridine-3-carboxamide
CID 56710225
N-[2-(furan-2-carbonylamino)ethyl]-1H-indole-3-carboxamide
CID 42581260
N-[2-(methylsulfamoyl)ethyl]-1H-indole-3-carboxamide
CID 84541178

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide?
The IUPAC name of N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide (CID 56704628) is N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide.
What is the SMILES notation for N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide?
The canonical SMILES for N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide is CCN1CCOC(CCNC(=O)c2c[nH]c3ccccc23)C1.
What is the InChIKey of N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide?
The InChIKey is VNJJUVCJWVZVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-2-20-9-10-22-13(12-20)7-8-18-17(21)15-11-19-16-6-4-3-5-14(15)16/h3-6,11,13,19H,2,7-10,12H2,1H3,(H,18,21).
What are the key properties of N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide?
N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylmorpholin-2-yl)ethyl]-1H-indole-3-carboxamide is sourced from PubChem (CID 56704628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).