2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine

C13H19N — CID 83829383

IUPAC2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
SMILESCc1cccc2c1C(CCN)CCC2
InChIInChI=1S/C13H19N/c1-10-4-2-5-11-6-3-7-12(8-9-14)13(10)11/h2,4-5,12H,3,6-9,14H2,1H3
InChIKeyNNWFNFUUMGOUKF-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.76
Rot. Bonds2

About 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine

2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine (PubChem CID 83829383) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
PubChem CID83829383
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
SMILESCc1cccc2c1C(CCN)CCC2
InChIInChI=1S/C13H19N/c1-10-4-2-5-11-6-3-7-12(8-9-14)13(10)11/h2,4-5,12H,3,6-9,14H2,1H3
InChIKeyNNWFNFUUMGOUKF-UHFFFAOYSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The IUPAC name of 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine (CID 83829383) is 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine.
What is the SMILES notation for 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The canonical SMILES for 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine is Cc1cccc2c1C(CCN)CCC2.
What is the InChIKey of 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The InChIKey is NNWFNFUUMGOUKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-10-4-2-5-11-6-3-7-12(8-9-14)13(10)11/h2,4-5,12H,3,6-9,14H2,1H3.
What are the key properties of 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine has a molecular weight of 189.30 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine is sourced from PubChem (CID 83829383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).