4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride

C16H24ClN — CID 70543749

IUPAC4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride
SMILESCl.c1ccc2c(c1)CCC2CCC1CCNCC1
InChIInChI=1S/C16H23N.ClH/c1-2-4-16-14(3-1)7-8-15(16)6-5-13-9-11-17-12-10-13;/h1-4,13,15,17H,5-12H2;1H
InChIKeyUARIHESPQNEGAU-UHFFFAOYSA-N
MW265.83 g/mol
LogP3.92
Rot. Bonds3

About 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride

4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride (PubChem CID 70543749) has the molecular formula C16H24ClN and a molecular weight of 265.83 g/mol. Its IUPAC name is 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride.

Molecular Properties

Compound Name4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride
PubChem CID70543749
Molecular FormulaC16H24ClN
Molecular Weight265.83 g/mol
Exact Mass265.16
IUPAC Name4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride
SMILESCl.c1ccc2c(c1)CCC2CCC1CCNCC1
InChIInChI=1S/C16H23N.ClH/c1-2-4-16-14(3-1)7-8-15(16)6-5-13-9-11-17-12-10-13;/h1-4,13,15,17H,5-12H2;1H
InChIKeyUARIHESPQNEGAU-UHFFFAOYSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.83
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
N-methyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 119929963
4-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxymethyl)piperidine
CID 63771604
1-ethyl-2,3-dihydro-1H-indene
CID 20971
4-[(1S)-2,3-dihydro-1H-inden-1-yl]piperidine
CID 92981221
1-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-indene
CID 147654820
1-(3-piperidin-4-ylpropoxy)-1,2,3,4-tetrahydroisoquinoline
CID 91105632
(1R)-1-hexadecyl-2,3-dihydro-1H-indene
CID 98094176
4-[2-(1H-inden-1-yl)ethyl]piperidine;hydrochloride
CID 20520183
2-[2,3-dihydro-1H-inden-1-yl(piperidin-4-ylmethyl)amino]ethanol;hydrochloride
CID 119931686
2-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-ethylethanamine
CID 124705366
N-(2,3-dihydro-1H-inden-1-yl)-2-piperidin-4-ylacetamide
CID 54910439

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride?
The IUPAC name of 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride (CID 70543749) is 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride.
What is the SMILES notation for 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride?
The canonical SMILES for 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride is Cl.c1ccc2c(c1)CCC2CCC1CCNCC1.
What is the InChIKey of 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride?
The InChIKey is UARIHESPQNEGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N.ClH/c1-2-4-16-14(3-1)7-8-15(16)6-5-13-9-11-17-12-10-13;/h1-4,13,15,17H,5-12H2;1H.
What are the key properties of 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride?
4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride has a molecular weight of 265.83 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]piperidine;hydrochloride is sourced from PubChem (CID 70543749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).