2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine

C15H19NO — CID 123913682

IUPAC2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine
SMILESCC(C)c1ccc2cc(OCCN)ccc2c1
InChIInChI=1S/C15H19NO/c1-11(2)12-3-4-14-10-15(17-8-7-16)6-5-13(14)9-12/h3-6,9-11H,7-8,16H2,1-2H3
InChIKeyYVQGJKPKVMWJKQ-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.30
Rot. Bonds4

About 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine

2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine (PubChem CID 123913682) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine.

Molecular Properties

Compound Name2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine
PubChem CID123913682
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine
SMILESCC(C)c1ccc2cc(OCCN)ccc2c1
InChIInChI=1S/C15H19NO/c1-11(2)12-3-4-14-10-15(17-8-7-16)6-5-13(14)9-12/h3-6,9-11H,7-8,16H2,1-2H3
InChIKeyYVQGJKPKVMWJKQ-UHFFFAOYSA-N
XLogP3.30
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine?
The IUPAC name of 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine (CID 123913682) is 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine.
What is the SMILES notation for 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine?
The canonical SMILES for 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine is CC(C)c1ccc2cc(OCCN)ccc2c1.
What is the InChIKey of 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine?
The InChIKey is YVQGJKPKVMWJKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11(2)12-3-4-14-10-15(17-8-7-16)6-5-13(14)9-12/h3-6,9-11H,7-8,16H2,1-2H3.
What are the key properties of 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine?
2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine has a molecular weight of 229.32 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine is sourced from PubChem (CID 123913682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).