N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine

C15H13Br2N — CID 107597685

IUPACN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESBrc1cccc(Br)c1NC1Cc2ccccc2C1
InChIInChI=1S/C15H13Br2N/c16-13-6-3-7-14(17)15(13)18-12-8-10-4-1-2-5-11(10)9-12/h1-7,12,18H,8-9H2
InChIKeyMIQCYLXTMCRSOG-UHFFFAOYSA-N
MW367.08 g/mol
LogP4.79
Rot. Bonds2

About N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine

N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 107597685) has the molecular formula C15H13Br2N and a molecular weight of 367.08 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID107597685
Molecular FormulaC15H13Br2N
Molecular Weight367.08 g/mol
Exact Mass364.94
IUPAC NameN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESBrc1cccc(Br)c1NC1Cc2ccccc2C1
InChIInChI=1S/C15H13Br2N/c16-13-6-3-7-14(17)15(13)18-12-8-10-4-1-2-5-11(10)9-12/h1-7,12,18H,8-9H2
InChIKeyMIQCYLXTMCRSOG-UHFFFAOYSA-N
XLogP4.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.08
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine (CID 107597685) is N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine is Brc1cccc(Br)c1NC1Cc2ccccc2C1.
What is the InChIKey of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is MIQCYLXTMCRSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Br2N/c16-13-6-3-7-14(17)15(13)18-12-8-10-4-1-2-5-11(10)9-12/h1-7,12,18H,8-9H2.
What are the key properties of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine?
N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 367.08 g/mol, XLogP of 4.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 107597685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).