7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride

C9H11BrClN — CID 127264661

IUPAC7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride
SMILESCl.NC1CCc2cccc(Br)c21
InChIInChI=1S/C9H10BrN.ClH/c10-7-3-1-2-6-4-5-8(11)9(6)7;/h1-3,8H,4-5,11H2;1H
InChIKeyJHZGPZBKLDACAV-UHFFFAOYSA-N
MW248.55 g/mol
LogP2.82
Rot. Bonds

About 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride

7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride (PubChem CID 127264661) has the molecular formula C9H11BrClN and a molecular weight of 248.55 g/mol. Its IUPAC name is 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride.

Molecular Properties

Compound Name7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride
PubChem CID127264661
Molecular FormulaC9H11BrClN
Molecular Weight248.55 g/mol
Exact Mass246.98
IUPAC Name7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride
SMILESCl.NC1CCc2cccc(Br)c21
InChIInChI=1S/C9H10BrN.ClH/c10-7-3-1-2-6-4-5-8(11)9(6)7;/h1-3,8H,4-5,11H2;1H
InChIKeyJHZGPZBKLDACAV-UHFFFAOYSA-N
XLogP2.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.55
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-(-)-1-Aminoindan
CID 2733933
1-Aminoindane, (S)-
CID 7000084
(+-)-1-Aminoindan
CID 123445
1-Aminoindane Hydrochloride
CID 2794441
5-bromo-2,3-dihydro-1H-inden-2-amine
CID 11298795
CA inhibitor, 5
CID 12192061
(S)-1-(3-bromophenyl)ethanamine
CID 9952938
(R)-1-(3-bromophenyl)ethanamine
CID 22831503
1-(2-Bromophenyl)ethan-1-amine
CID 3825290
1-(3-Bromophenyl)ethan-1-amine hydrochloride
CID 21975861
(1R)-2,3-dihydro-1H-inden-1-amine hydrochloride
CID 12370443
6-Bromo-2,3-dihydro-1H-inden-1-amine
CID 16244315

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride?
The IUPAC name of 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride (CID 127264661) is 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride.
What is the SMILES notation for 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride?
The canonical SMILES for 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride is Cl.NC1CCc2cccc(Br)c21.
What is the InChIKey of 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride?
The InChIKey is JHZGPZBKLDACAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN.ClH/c10-7-3-1-2-6-4-5-8(11)9(6)7;/h1-3,8H,4-5,11H2;1H.
What are the key properties of 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride?
7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride has a molecular weight of 248.55 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,3-dihydro-1H-inden-1-amine;hydrochloride is sourced from PubChem (CID 127264661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).