2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride

C15H22ClNO — CID 164888275

IUPAC2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride
SMILESCl.c1cc2c(c(OCC3CCCCN3)c1)CCC2
InChIInChI=1S/C15H21NO.ClH/c1-2-10-16-13(7-1)11-17-15-9-4-6-12-5-3-8-14(12)15;/h4,6,9,13,16H,1-3,5,7-8,10-11H2;1H
InChIKeyCVXOENHAECVFOA-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.12
Rot. Bonds3

About 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride

2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride (PubChem CID 164888275) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride
PubChem CID164888275
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC Name2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride
SMILESCl.c1cc2c(c(OCC3CCCCN3)c1)CCC2
InChIInChI=1S/C15H21NO.ClH/c1-2-10-16-13(7-1)11-17-15-9-4-6-12-5-3-8-14(12)15;/h4,6,9,13,16H,1-3,5,7-8,10-11H2;1H
InChIKeyCVXOENHAECVFOA-UHFFFAOYSA-N
XLogP3.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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[2-[[(2R)-pyrrolidin-2-yl]methoxy]phenyl]methanol
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2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)piperidine
CID 54943160
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CID 102820264
2-[(3-chloro-2-nitrophenoxy)methyl]piperidine
CID 113459399
(2R)-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]pyrrolidine
CID 102820001
2-bromo-6-(piperidin-2-ylmethoxy)benzamide
CID 114887724
2-(phenoxymethyl)pyrrolidine;hydrochloride
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CID 62349156

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride?
The IUPAC name of 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride (CID 164888275) is 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride is Cl.c1cc2c(c(OCC3CCCCN3)c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride?
The InChIKey is CVXOENHAECVFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO.ClH/c1-2-10-16-13(7-1)11-17-15-9-4-6-12-5-3-8-14(12)15;/h4,6,9,13,16H,1-3,5,7-8,10-11H2;1H.
What are the key properties of 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride?
2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride has a molecular weight of 267.80 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride is sourced from PubChem (CID 164888275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).