2-benzyl-2,3-dihydro-1H-inden-1-amine

C16H17N — CID 46230981

IUPAC2-benzyl-2,3-dihydro-1H-inden-1-amine
SMILESNC1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C16H17N/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16H,10-11,17H2
InChIKeyROOXLJXVKMILCY-UHFFFAOYSA-N
MW223.32 g/mol
LogP3.10
Rot. Bonds2

About 2-benzyl-2,3-dihydro-1H-inden-1-amine

2-benzyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 46230981) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-benzyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name2-benzyl-2,3-dihydro-1H-inden-1-amine
PubChem CID46230981
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name2-benzyl-2,3-dihydro-1H-inden-1-amine
SMILESNC1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C16H17N/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16H,10-11,17H2
InChIKeyROOXLJXVKMILCY-UHFFFAOYSA-N
XLogP3.10
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 2-benzyl-2,3-dihydro-1H-inden-1-amine (CID 46230981) is 2-benzyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 2-benzyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 2-benzyl-2,3-dihydro-1H-inden-1-amine is NC1c2ccccc2CC1Cc1ccccc1.
What is the InChIKey of 2-benzyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ROOXLJXVKMILCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16H,10-11,17H2.
What are the key properties of 2-benzyl-2,3-dihydro-1H-inden-1-amine?
2-benzyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 223.32 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 46230981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).