1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine

C18H21N — CID 43115557

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1ccc2c(c1)CCC2
InChIInChI=1S/C18H21N/c1-13-5-2-3-6-15(13)12-18(19)17-10-9-14-7-4-8-16(14)11-17/h2-3,5-6,9-11,18H,4,7-8,12,19H2,1H3
InChIKeyPEIFPJDSKAKCGE-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.73
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine

1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine (PubChem CID 43115557) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine
PubChem CID43115557
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1ccc2c(c1)CCC2
InChIInChI=1S/C18H21N/c1-13-5-2-3-6-15(13)12-18(19)17-10-9-14-7-4-8-16(14)11-17/h2-3,5-6,9-11,18H,4,7-8,12,19H2,1H3
InChIKeyPEIFPJDSKAKCGE-UHFFFAOYSA-N
XLogP3.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43100360
2-(2,3-dihydro-1H-inden-5-yl)-1-(3,4-dimethylphenyl)ethanamine
CID 115864878
1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826448
2-(4-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43152415
5-[1-amino-2-(2-methylphenyl)ethyl]-1,3-dihydroindol-2-one
CID 43197980
5-[1-amino-2-(2-methylphenyl)ethyl]-1-methyl-3H-indol-2-one
CID 43119574
(1R)-1-(3,4-dimethoxyphenyl)-2-(2-methylphenyl)ethanamine
CID 42058451
1-(3,3-dimethyl-2H-1-benzofuran-5-yl)-2-(2-methylphenyl)ethanamine
CID 107293388
2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 115841589
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 115864950
2-(3-chloro-4-pyridinyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 112655443
1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine
CID 105034568

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine (CID 43115557) is 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine is Cc1ccccc1CC(N)c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine?
The InChIKey is PEIFPJDSKAKCGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-13-5-2-3-6-15(13)12-18(19)17-10-9-14-7-4-8-16(14)11-17/h2-3,5-6,9-11,18H,4,7-8,12,19H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine?
1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine has a molecular weight of 251.37 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 43115557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).