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

C15H13Br2N — CID 107597542

IUPACN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESBrc1cccc(Br)c1NC1CCc2ccccc21
InChIInChI=1S/C15H13Br2N/c16-12-6-3-7-13(17)15(12)18-14-9-8-10-4-1-2-5-11(10)14/h1-7,14,18H,8-9H2
InChIKeyKWCPAAFHEKTHHI-UHFFFAOYSA-N
MW367.08 g/mol
LogP5.31
Rot. Bonds2

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

N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 107597542) 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-1-amine.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID107597542
Molecular FormulaC15H13Br2N
Molecular Weight367.08 g/mol
Exact Mass364.94
IUPAC NameN-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESBrc1cccc(Br)c1NC1CCc2ccccc21
InChIInChI=1S/C15H13Br2N/c16-12-6-3-7-13(17)15(12)18-14-9-8-10-4-1-2-5-11(10)14/h1-7,14,18H,8-9H2
InChIKeyKWCPAAFHEKTHHI-UHFFFAOYSA-N
XLogP5.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.08
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,4,6-tribromophenyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63425782
N-(2,6-dibromophenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107597579
N-(2,6-dichloro-4-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 83077299
N-(2-bromo-4-chlorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 81263302
N-(2-bromo-4-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 43119403
N-(2,6-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65470081
5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
CID 169260360
N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43196442
N-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627798
N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-2-amine
CID 107597685
3-bromo-2-chloro-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 103981419
N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine
CID 115591065

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine (CID 107597542) is N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine is Brc1cccc(Br)c1NC1CCc2ccccc21.
What is the InChIKey of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KWCPAAFHEKTHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Br2N/c16-12-6-3-7-13(17)15(12)18-14-9-8-10-4-1-2-5-11(10)14/h1-7,14,18H,8-9H2.
What are the key properties of N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine?
N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 367.08 g/mol, XLogP of 5.31, 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-1-amine is sourced from PubChem (CID 107597542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).