2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride

C11H16ClN — CID 70023036

IUPAC2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride
SMILESCl.NCCC1Cc2ccccc2C1
InChIInChI=1S/C11H15N.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)8-9;/h1-4,9H,5-8,12H2;1H
InChIKeyHJFSCCGGNNBQQA-UHFFFAOYSA-N
MW197.71 g/mol
LogP2.17
Rot. Bonds2

About 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride

2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride (PubChem CID 70023036) has the molecular formula C11H16ClN and a molecular weight of 197.71 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride
PubChem CID70023036
Molecular FormulaC11H16ClN
Molecular Weight197.71 g/mol
Exact Mass197.10
IUPAC Name2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride
SMILESCl.NCCC1Cc2ccccc2C1
InChIInChI=1S/C11H15N.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)8-9;/h1-4,9H,5-8,12H2;1H
InChIKeyHJFSCCGGNNBQQA-UHFFFAOYSA-N
XLogP2.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.71
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride (CID 70023036) is 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride is Cl.NCCC1Cc2ccccc2C1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride?
The InChIKey is HJFSCCGGNNBQQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)8-9;/h1-4,9H,5-8,12H2;1H.
What are the key properties of 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride?
2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride has a molecular weight of 197.71 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 70023036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).