(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine

C23H23N — CID 172834225

IUPAC(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1ccccc1-c1cccc(-c2ccc3c(c2)C[C@H](N)C3)c1C
InChIInChI=1S/C23H23N/c1-15-6-3-4-7-21(15)23-9-5-8-22(16(23)2)18-11-10-17-13-20(24)14-19(17)12-18/h3-12,20H,13-14,24H2,1-2H3/t20-/m1/s1
InChIKeyVXXDCLWTTVDYIA-HXUWFJFHSA-N
MW313.44 g/mol
LogP5.06
Rot. Bonds2

About (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine

(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 172834225) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID172834225
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC Name(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1ccccc1-c1cccc(-c2ccc3c(c2)C[C@H](N)C3)c1C
InChIInChI=1S/C23H23N/c1-15-6-3-4-7-21(15)23-9-5-8-22(16(23)2)18-11-10-17-13-20(24)14-19(17)12-18/h3-12,20H,13-14,24H2,1-2H3/t20-/m1/s1
InChIKeyVXXDCLWTTVDYIA-HXUWFJFHSA-N
XLogP5.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.44
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-4-[2-methyl-3-(2-methylphenyl)phenyl]-2-(2-methylphenyl)benzene
CID 144952887
ethane;3-[2-(2-methylphenyl)phenyl]bicyclo[4.2.0]octa-1(6),2,4-triene
CID 144980545
5-(2,3-dimethylphenyl)-2,3-dihydro-1H-indene
CID 173291568
6-(2-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 166257815
1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene
CID 123207081
2,3-dihydro-1H-inden-2-amine;ethane
CID 142154792
1-tert-butyl-6-[2-methyl-3-(2-methylphenyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid
CID 175213819
9H-fluorene;9-methyltetracyclo[6.5.0.04,12.05,10]trideca-1(13),2,4(12),5(10),6,8-hexaene
CID 173160450
5-chloro-2,3-dihydro-1H-inden-2-amine;2,3-dihydro-1H-inden-2-amine
CID 167560808
2-methyl-1,3-bis(2-methyl-4-phenylphenyl)benzene
CID 162497500
2-[8-(2-methylphenyl)-9H-fluoren-1-yl]triphenylene
CID 157108614
6-(2-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 169410347

Frequently Asked Questions

What is the IUPAC name of (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine (CID 172834225) is (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine is Cc1ccccc1-c1cccc(-c2ccc3c(c2)C[C@H](N)C3)c1C.
What is the InChIKey of (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is VXXDCLWTTVDYIA-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H23N/c1-15-6-3-4-7-21(15)23-9-5-8-22(16(23)2)18-11-10-17-13-20(24)14-19(17)12-18/h3-12,20H,13-14,24H2,1-2H3/t20-/m1/s1.
What are the key properties of (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
(2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 313.44 g/mol, XLogP of 5.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-[2-methyl-3-(2-methylphenyl)phenyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 172834225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).