1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine

C15H23N3O — CID 114456230

IUPAC1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine
SMILESCCN1CCOC(CN2CCc3cccc(N)c32)C1
InChIInChI=1S/C15H23N3O/c1-2-17-8-9-19-13(10-17)11-18-7-6-12-4-3-5-14(16)15(12)18/h3-5,13H,2,6-11,16H2,1H3
InChIKeyKVGXAPBUMORKMV-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.35
Rot. Bonds3

About 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine

1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine (PubChem CID 114456230) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine.

Molecular Properties

Compound Name1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine
PubChem CID114456230
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine
SMILESCCN1CCOC(CN2CCc3cccc(N)c32)C1
InChIInChI=1S/C15H23N3O/c1-2-17-8-9-19-13(10-17)11-18-7-6-12-4-3-5-14(16)15(12)18/h3-5,13H,2,6-11,16H2,1H3
InChIKeyKVGXAPBUMORKMV-UHFFFAOYSA-N
XLogP1.35
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(oxolan-2-ylmethyl)-2,3-dihydroindol-7-amine
CID 114456219
1-[(4-ethylmorpholin-2-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine
CID 79182791
1-[3-(oxolan-2-yl)propyl]-2,3-dihydroindol-7-amine
CID 114456562
3-[(4-ethylmorpholin-2-yl)methylsulfinyl]-2-methylaniline
CID 81190289
1-[2-(4-methylpiperazin-1-yl)ethyl]-2,3-dihydroindol-7-amine
CID 114456237
1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine
CID 114400417
1-nonyl-2,3-dihydroindol-7-amine
CID 114456337
2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methylbenzamide
CID 114398978
4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 114401064
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-2,5-dione
CID 114400408
3-amino-2-[(4-ethylmorpholin-2-yl)methoxy]benzamide
CID 107873410
2-(7-amino-2,3-dihydroindol-1-yl)-N,N-dimethylacetamide
CID 114456689

Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine?
The IUPAC name of 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine (CID 114456230) is 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine.
What is the SMILES notation for 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine?
The canonical SMILES for 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine is CCN1CCOC(CN2CCc3cccc(N)c32)C1.
What is the InChIKey of 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine?
The InChIKey is KVGXAPBUMORKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-17-8-9-19-13(10-17)11-18-7-6-12-4-3-5-14(16)15(12)18/h3-5,13H,2,6-11,16H2,1H3.
What are the key properties of 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine?
1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine has a molecular weight of 261.37 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydroindol-7-amine is sourced from PubChem (CID 114456230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).