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

C17H19N — CID 43196442

IUPACN-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
SMILESCc1cccc(NC2CCc3ccccc32)c1C
InChIInChI=1S/C17H19N/c1-12-6-5-9-16(13(12)2)18-17-11-10-14-7-3-4-8-15(14)17/h3-9,17-18H,10-11H2,1-2H3
InChIKeyZEHDGLLMYBSQOK-UHFFFAOYSA-N
MW237.35 g/mol
LogP4.40
Rot. Bonds2

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

N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 43196442) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID43196442
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC NameN-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
SMILESCc1cccc(NC2CCc3ccccc32)c1C
InChIInChI=1S/C17H19N/c1-12-6-5-9-16(13(12)2)18-17-11-10-14-7-3-4-8-15(14)17/h3-9,17-18H,10-11H2,1-2H3
InChIKeyZEHDGLLMYBSQOK-UHFFFAOYSA-N
XLogP4.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-fluoro-2-methylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43195451
N-(2-ethoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43191712
N-(2,3-dimethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 55122146
N-(3-bromo-2-methylphenyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 107630133
N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine
CID 107597542
N-[2-(2-methylpropoxy)phenyl]-2,3-dihydro-1H-inden-1-amine
CID 63453182
N-[2-(trifluoromethylsulfanyl)phenyl]-2,3-dihydro-1H-inden-1-amine
CID 43676731
N-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627798
2-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzene-1,2-diamine
CID 62305429
methyl 2-(2,3-dihydro-1H-inden-1-ylamino)-5-methylbenzoate
CID 43679244
6-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methylpyridin-3-amine
CID 114049295
N-(2-bromo-4-chlorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 81263302

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine (CID 43196442) is N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine is Cc1cccc(NC2CCc3ccccc32)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ZEHDGLLMYBSQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-12-6-5-9-16(13(12)2)18-17-11-10-14-7-3-4-8-15(14)17/h3-9,17-18H,10-11H2,1-2H3.
What are the key properties of N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine?
N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 237.35 g/mol, XLogP of 4.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 43196442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).