(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine

C17H19N — CID 101384659

IUPAC(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine
SMILESC[C@@H]1Cc2ccccc2[C@@H]1NCc1ccccc1
InChIInChI=1S/C17H19N/c1-13-11-15-9-5-6-10-16(15)17(13)18-12-14-7-3-2-4-8-14/h2-10,13,17-18H,11-12H2,1H3/t13-,17-/m1/s1
InChIKeyUZQLKZQQUXXQIQ-CXAGYDPISA-N
MW237.35 g/mol
LogP3.71
Rot. Bonds3

About (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine

(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 101384659) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID101384659
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine
SMILESC[C@@H]1Cc2ccccc2[C@@H]1NCc1ccccc1
InChIInChI=1S/C17H19N/c1-13-11-15-9-5-6-10-16(15)17(13)18-12-14-7-3-2-4-8-14/h2-10,13,17-18H,11-12H2,1H3/t13-,17-/m1/s1
InChIKeyUZQLKZQQUXXQIQ-CXAGYDPISA-N
XLogP3.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine
CID 70031705
N,2-dimethyl-2,3-dihydro-1H-inden-1-amine;ethane
CID 142067268
(1R,2S)-1-[(4-tert-butylphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 49463406
1-(pyridin-4-ylmethylamino)-2,3-dihydro-1H-inden-2-ol
CID 71922626
(1R,2S)-1-[(3-phenylphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 47075671
(3R,4S)-N,1-dibenzyl-3-methyl-3,4-dihydro-2H-quinolin-4-amine
CID 101357683
N,2,2-trimethyl-3-[[(1R,2R)-2-methyl-2,3-dihydro-1H-inden-1-yl]amino]propanamide
CID 99777424
(1R,2S)-1-[(3-phenoxyphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 52806530
N-[(1R,2R)-2-methyl-2,3-dihydro-1H-inden-1-yl]methanesulfonamide
CID 95318308
N-cyclopentyl-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 115889725
4-[[[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]methyl]benzonitrile
CID 49463146
(1R,2S)-1-[(3,4-dimethylphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 49463366

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine (CID 101384659) is (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine is C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccccc1.
What is the InChIKey of (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is UZQLKZQQUXXQIQ-CXAGYDPISA-N. The full InChI is InChI=1S/C17H19N/c1-13-11-15-9-5-6-10-16(15)17(13)18-12-14-7-3-2-4-8-14/h2-10,13,17-18H,11-12H2,1H3/t13-,17-/m1/s1.
What are the key properties of (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine?
(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 237.35 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 101384659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).