1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine

C14H14F3NO — CID 16780890

IUPAC1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESNC(COCC(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C14H14F3NO/c15-14(16,17)9-19-8-13(18)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13H,8-9,18H2
InChIKeySNDRPIQYURJEPZ-UHFFFAOYSA-N
MW269.27 g/mol
LogP3.42
Rot. Bonds4

About 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine

1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine (PubChem CID 16780890) has the molecular formula C14H14F3NO and a molecular weight of 269.27 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine
PubChem CID16780890
Molecular FormulaC14H14F3NO
Molecular Weight269.27 g/mol
Exact Mass269.10
IUPAC Name1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESNC(COCC(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C14H14F3NO/c15-14(16,17)9-19-8-13(18)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13H,8-9,18H2
InChIKeySNDRPIQYURJEPZ-UHFFFAOYSA-N
XLogP3.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.27
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 107289462
1-naphthalen-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275229
2-(3,3-dimethylbutoxy)-1-naphthalen-2-ylethanamine
CID 66234275
1-(4-propan-2-yloxyphenyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 16785577
1-(2,3-dihydro-1H-inden-5-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207092
2-butan-2-yloxy-1-naphthalen-2-ylethanamine
CID 54944139
3-ethoxy-1-naphthalen-2-ylpropan-1-amine
CID 112688301
1-(4-butan-2-ylphenyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207062
3-methoxy-3-methyl-1-naphthalen-2-ylbutan-1-amine
CID 103025801
2-(4-methylpentan-2-yloxy)-1-naphthalen-2-ylethanamine
CID 43105278
3-methyl-1-naphthalen-2-ylbutane-1,3-diamine
CID 116933649
1-pyridin-3-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103214655

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine?
The IUPAC name of 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine (CID 16780890) is 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine.
What is the SMILES notation for 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine?
The canonical SMILES for 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine is NC(COCC(F)(F)F)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine?
The InChIKey is SNDRPIQYURJEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3NO/c15-14(16,17)9-19-8-13(18)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13H,8-9,18H2.
What are the key properties of 1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine?
1-naphthalen-2-yl-2-(2,2,2-trifluoroethoxy)ethanamine has a molecular weight of 269.27 g/mol, XLogP of 3.42, 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-(2,2,2-trifluoroethoxy)ethanamine is sourced from PubChem (CID 16780890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).