anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole

C22H30N2O — CID 174390999

IUPACanisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole
SMILESCCN1CCC(N2CCc3ccccc32)CC1.COc1ccccc1
InChIInChI=1S/C15H22N2.C7H8O/c1-2-16-10-8-14(9-11-16)17-12-7-13-5-3-4-6-15(13)17;1-8-7-5-3-2-4-6-7/h3-6,14H,2,7-12H2,1H3;2-6H,1H3
InChIKeyYALFYESRKCPDOE-UHFFFAOYSA-N
MW338.50 g/mol
LogP4.23
Rot. Bonds3

About anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole

anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole (PubChem CID 174390999) has the molecular formula C22H30N2O and a molecular weight of 338.50 g/mol. Its IUPAC name is anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole.

Molecular Properties

Compound Nameanisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole
PubChem CID174390999
Molecular FormulaC22H30N2O
Molecular Weight338.50 g/mol
Exact Mass338.24
IUPAC Nameanisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole
SMILESCCN1CCC(N2CCc3ccccc32)CC1.COc1ccccc1
InChIInChI=1S/C15H22N2.C7H8O/c1-2-16-10-8-14(9-11-16)17-12-7-13-5-3-4-6-15(13)17;1-8-7-5-3-2-4-6-7/h3-6,14H,2,7-12H2,1H3;2-6H,1H3
InChIKeyYALFYESRKCPDOE-UHFFFAOYSA-N
XLogP4.23
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole;vanadium
CID 161158486
anisole;1-ethyl-4-(2-phenoxyethyl)piperidine
CID 174661948
1-(1-ethylpiperidin-4-yl)-6-[(1-ethylpiperidin-4-yl)methyl]-2,3-dihydroindole
CID 174441483
1-[1-[2-(3,5-difluorophenyl)ethyl]piperidin-4-yl]-2,3-dihydroindole
CID 22037972
2-[3-[2-[4-(2,3-dihydroindol-1-yl)piperidin-1-yl]ethyl]phenoxy]ethanol
CID 22038273
1-(1-ethylpiperidin-4-yl)-6-(pyridin-4-ylmethyl)-2,3-dihydroindole
CID 174391233
1-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]-2,3-dihydroindole
CID 120904397
2-[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]-2-(methylamino)acetaldehyde;fluorobenzene
CID 174405792
N-[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]-2-fluorobenzenesulfonamide
CID 174406027
1-(1-ethylpiperidin-4-yl)-3H-indol-2-one
CID 71199047
1-[1-[(E)-but-2-enyl]piperidin-4-yl]-3,4-dihydro-2H-quinoline
CID 21135886
1-[1-[3-(1,3-benzodioxol-5-yloxy)propyl]piperidin-4-yl]-2,3-dihydroindole
CID 22038018

Frequently Asked Questions

What is the IUPAC name of anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole?
The IUPAC name of anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole (CID 174390999) is anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole.
What is the SMILES notation for anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole?
The canonical SMILES for anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole is CCN1CCC(N2CCc3ccccc32)CC1.COc1ccccc1.
What is the InChIKey of anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole?
The InChIKey is YALFYESRKCPDOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2.C7H8O/c1-2-16-10-8-14(9-11-16)17-12-7-13-5-3-4-6-15(13)17;1-8-7-5-3-2-4-6-7/h3-6,14H,2,7-12H2,1H3;2-6H,1H3.
What are the key properties of anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole?
anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole has a molecular weight of 338.50 g/mol, XLogP of 4.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole is sourced from PubChem (CID 174390999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).