2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride

C10H14ClN — CID 54594123

IUPAC2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride
SMILESCl.NCC1Cc2ccccc2C1
InChIInChI=1S/C10H13N.ClH/c11-7-8-5-9-3-1-2-4-10(9)6-8;/h1-4,8H,5-7,11H2;1H
InChIKeyFBTMKYSIJBFIBH-UHFFFAOYSA-N
MW183.68 g/mol
LogP1.78
Rot. Bonds1

About 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride

2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride (PubChem CID 54594123) has the molecular formula C10H14ClN and a molecular weight of 183.68 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride
PubChem CID54594123
Molecular FormulaC10H14ClN
Molecular Weight183.68 g/mol
Exact Mass183.08
IUPAC Name2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride
SMILESCl.NCC1Cc2ccccc2C1
InChIInChI=1S/C10H13N.ClH/c11-7-8-5-9-3-1-2-4-10(9)6-8;/h1-4,8H,5-7,11H2;1H
InChIKeyFBTMKYSIJBFIBH-UHFFFAOYSA-N
XLogP1.78
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.68
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride?
The IUPAC name of 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride (CID 54594123) is 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride?
The canonical SMILES for 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride is Cl.NCC1Cc2ccccc2C1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride?
The InChIKey is FBTMKYSIJBFIBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.ClH/c11-7-8-5-9-3-1-2-4-10(9)6-8;/h1-4,8H,5-7,11H2;1H.
What are the key properties of 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride?
2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride has a molecular weight of 183.68 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-ylmethanamine;hydrochloride is sourced from PubChem (CID 54594123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).