2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

C18H21N — CID 65404384

IUPAC2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESNC(Cc1ccccc1)C1CCc2ccccc2C1
InChIInChI=1S/C18H21N/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-9,17-18H,10-13,19H2
InChIKeyJZOPUWVVXZHUIP-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.36
Rot. Bonds3

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

2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 65404384) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID65404384
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESNC(Cc1ccccc1)C1CCc2ccccc2C1
InChIInChI=1S/C18H21N/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-9,17-18H,10-13,19H2
InChIKeyJZOPUWVVXZHUIP-UHFFFAOYSA-N
XLogP3.36
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 ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (CID 65404384) is 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is NC(Cc1ccccc1)C1CCc2ccccc2C1.
What is the InChIKey of 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is JZOPUWVVXZHUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-9,17-18H,10-13,19H2.
What are the key properties of 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 251.37 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 65404384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).