2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

C20H25N — CID 65405157

IUPAC2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESCc1ccc(C)c(CC(N)C2CCc3ccccc3C2)c1
InChIInChI=1S/C20H25N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-8,11,18,20H,9-10,12-13,21H2,1-2H3
InChIKeyTVCFUGLILUWYSZ-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.98
Rot. Bonds3

About 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 65405157) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID65405157
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC Name2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESCc1ccc(C)c(CC(N)C2CCc3ccccc3C2)c1
InChIInChI=1S/C20H25N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-8,11,18,20H,9-10,12-13,21H2,1-2H3
InChIKeyTVCFUGLILUWYSZ-UHFFFAOYSA-N
XLogP3.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404581
[1-(2,3-dihydro-1H-inden-2-yl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105234118
2-(2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404776
2-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanamine
CID 106868280
1-(2,3-dihydro-1H-inden-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 65409528
2-(2,5-dimethylphenyl)-1-(4-methylcyclohexyl)ethanamine
CID 63415387
2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404384
2-(2-chloro-4-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65403993
2-(2,5-dimethylphenyl)-1-(thiolan-3-yl)ethanamine
CID 105101180
1,2,3,4-tetrahydronaphthalen-2-yl-(2,4,6-trimethylphenyl)methanamine
CID 107126496
2-(2,5-dimethylphenyl)-1-(3-ethylcyclopentyl)ethanamine
CID 65410217
2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404575

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (CID 65405157) is 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is Cc1ccc(C)c(CC(N)C2CCc3ccccc3C2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is TVCFUGLILUWYSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-8,11,18,20H,9-10,12-13,21H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 279.43 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 65405157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).