1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine

C15H16F3NO — CID 66275229

IUPAC1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
SMILESCC(OCC(N)c1ccc2ccccc2c1)C(F)(F)F
InChIInChI=1S/C15H16F3NO/c1-10(15(16,17)18)20-9-14(19)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14H,9,19H2,1H3
InChIKeyFWZLZWFDFDKAIV-UHFFFAOYSA-N
MW283.29 g/mol
LogP3.81
Rot. Bonds4

About 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine

1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine (PubChem CID 66275229) has the molecular formula C15H16F3NO and a molecular weight of 283.29 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
PubChem CID66275229
Molecular FormulaC15H16F3NO
Molecular Weight283.29 g/mol
Exact Mass283.12
IUPAC Name1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
SMILESCC(OCC(N)c1ccc2ccccc2c1)C(F)(F)F
InChIInChI=1S/C15H16F3NO/c1-10(15(16,17)18)20-9-14(19)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14H,9,19H2,1H3
InChIKeyFWZLZWFDFDKAIV-UHFFFAOYSA-N
XLogP3.81
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yloxy-1-naphthalen-2-ylethanamine
CID 54944139
1-phenyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275435
2-(4-methylpentan-2-yloxy)-1-naphthalen-2-ylethanamine
CID 43105278
1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 16780890
1-(4-tert-butylphenyl)-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275444
2-(3,3-dimethylbutoxy)-1-naphthalen-2-ylethanamine
CID 66234275
1-[4-(2-methylpropyl)phenyl]-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275431
2-methyl-1-naphthalen-2-ylbutan-1-amine
CID 63718165
(1R)-3-methyl-1-naphthalen-2-ylbutan-1-amine;hydrochloride
CID 171201317
3-methoxy-3-methyl-1-naphthalen-2-ylbutan-1-amine
CID 103025801
1-(6-bromonaphthalen-2-yl)-2-propan-2-yloxyethanamine
CID 105013461
N'-methyl-N'-(2-methylbutyl)-1-naphthalen-2-ylethane-1,2-diamine
CID 43295722

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The IUPAC name of 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine (CID 66275229) is 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine.
What is the SMILES notation for 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The canonical SMILES for 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine is CC(OCC(N)c1ccc2ccccc2c1)C(F)(F)F.
What is the InChIKey of 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The InChIKey is FWZLZWFDFDKAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3NO/c1-10(15(16,17)18)20-9-14(19)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14H,9,19H2,1H3.
What are the key properties of 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine has a molecular weight of 283.29 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine is sourced from PubChem (CID 66275229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).