2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine

C15H23N — CID 84622720

IUPAC2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
SMILESCc1cc(C)c2c(c1)C(CCN)CC(C)C2
InChIInChI=1S/C15H23N/c1-10-6-12(3)14-8-11(2)7-13(4-5-16)15(14)9-10/h6,9,11,13H,4-5,7-8,16H2,1-3H3
InChIKeyPOUOMAZJMQGESE-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.32
Rot. Bonds2

About 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine

2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine (PubChem CID 84622720) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
PubChem CID84622720
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
SMILESCc1cc(C)c2c(c1)C(CCN)CC(C)C2
InChIInChI=1S/C15H23N/c1-10-6-12(3)14-8-11(2)7-13(4-5-16)15(14)9-10/h6,9,11,13H,4-5,7-8,16H2,1-3H3
InChIKeyPOUOMAZJMQGESE-UHFFFAOYSA-N
XLogP3.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The IUPAC name of 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine (CID 84622720) is 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine.
What is the SMILES notation for 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The canonical SMILES for 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine is Cc1cc(C)c2c(c1)C(CCN)CC(C)C2.
What is the InChIKey of 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
The InChIKey is POUOMAZJMQGESE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-10-6-12(3)14-8-11(2)7-13(4-5-16)15(14)9-10/h6,9,11,13H,4-5,7-8,16H2,1-3H3.
What are the key properties of 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine?
2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5,7-trimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine is sourced from PubChem (CID 84622720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).