2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine

C15H23FN2O — CID 107520369

IUPAC2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine
SMILESCCOC1CCCN(CC(N)c2ccc(F)cc2)C1
InChIInChI=1S/C15H23FN2O/c1-2-19-14-4-3-9-18(10-14)11-15(17)12-5-7-13(16)8-6-12/h5-8,14-15H,2-4,9-11,17H2,1H3
InChIKeyMYTMQJBROHJQDC-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.33
Rot. Bonds5

About 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine

2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine (PubChem CID 107520369) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine
PubChem CID107520369
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine
SMILESCCOC1CCCN(CC(N)c2ccc(F)cc2)C1
InChIInChI=1S/C15H23FN2O/c1-2-19-14-4-3-9-18(10-14)11-15(17)12-5-7-13(16)8-6-12/h5-8,14-15H,2-4,9-11,17H2,1H3
InChIKeyMYTMQJBROHJQDC-UHFFFAOYSA-N
XLogP2.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethoxypiperidin-1-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291229
2-(3-ethoxypiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 54985150
4-(3-ethoxypiperidin-1-yl)-1-phenylbutan-1-amine
CID 63322069
1-[2-amino-2-(4-fluorophenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 107521053
2-(4-ethylpiperidin-1-yl)-1-(4-fluorophenyl)ethanamine
CID 107520014
2-(3-tert-butylpyrrolidin-1-yl)-1-(4-fluorophenyl)ethanamine
CID 107521966
1-(4-fluorophenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 16643559
2-(2-ethylpyrrolidin-1-yl)-1-(4-fluorophenyl)ethanamine
CID 107519853
1-(4-fluorophenyl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 107520786
1-(4-fluorophenyl)-3-(3-methoxypiperidin-1-yl)propan-1-ol
CID 102967568
1-[1-[2-(4-fluorophenyl)propyl]piperidin-3-yl]ethanamine
CID 120841093
2-[3-(methoxymethyl)piperidin-1-yl]-1-(4-methylphenyl)ethanamine
CID 106586509

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine?
The IUPAC name of 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine (CID 107520369) is 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine?
The canonical SMILES for 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine is CCOC1CCCN(CC(N)c2ccc(F)cc2)C1.
What is the InChIKey of 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine?
The InChIKey is MYTMQJBROHJQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-2-19-14-4-3-9-18(10-14)11-15(17)12-5-7-13(16)8-6-12/h5-8,14-15H,2-4,9-11,17H2,1H3.
What are the key properties of 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine?
2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine has a molecular weight of 266.36 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxypiperidin-1-yl)-1-(4-fluorophenyl)ethanamine is sourced from PubChem (CID 107520369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).