N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine

C23H23N — CID 70031705

IUPACN,2-dibenzyl-2,3-dihydro-1H-inden-1-amine
SMILESc1ccc(CNC2c3ccccc3CC2Cc2ccccc2)cc1
InChIInChI=1S/C23H23N/c1-3-9-18(10-4-1)15-21-16-20-13-7-8-14-22(20)23(21)24-17-19-11-5-2-6-12-19/h1-14,21,23-24H,15-17H2
InChIKeySWDACARNCTWPQM-UHFFFAOYSA-N
MW313.44 g/mol
LogP4.93
Rot. Bonds5

About N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine

N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 70031705) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN,2-dibenzyl-2,3-dihydro-1H-inden-1-amine
PubChem CID70031705
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC NameN,2-dibenzyl-2,3-dihydro-1H-inden-1-amine
SMILESc1ccc(CNC2c3ccccc3CC2Cc2ccccc2)cc1
InChIInChI=1S/C23H23N/c1-3-9-18(10-4-1)15-21-16-20-13-7-8-14-22(20)23(21)24-17-19-11-5-2-6-12-19/h1-14,21,23-24H,15-17H2
InChIKeySWDACARNCTWPQM-UHFFFAOYSA-N
XLogP4.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.44
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2R)-N-benzyl-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 101384659
3-benzyl-N-ethyl-2-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79736974
2-[(4-iodophenyl)methyl]-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 65477430
2-benzyl-1-bromo-2,3-dihydro-1H-indene
CID 63470495
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
4-[[[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]methyl]benzonitrile
CID 49463146
(1R,2S)-1-[(4-tert-butylphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 49463406
(1R,2S)-1-[(3-phenoxyphenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 52806530
2-[(5-bromo-3-pyridinyl)methyl]-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 104799962
2-chloro-N-(pyridin-3-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 65024916
1-benzyl-N-methyl-2,3-dihydro-1H-inden-2-amine;hydrochloride
CID 23203044

Frequently Asked Questions

What is the IUPAC name of N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine (CID 70031705) is N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine is c1ccc(CNC2c3ccccc3CC2Cc2ccccc2)cc1.
What is the InChIKey of N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is SWDACARNCTWPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N/c1-3-9-18(10-4-1)15-21-16-20-13-7-8-14-22(20)23(21)24-17-19-11-5-2-6-12-19/h1-14,21,23-24H,15-17H2.
What are the key properties of N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine?
N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 313.44 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dibenzyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 70031705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).