N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine

C15H18FNO2 — CID 63935555

IUPACN-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(COCc2ccccc2F)o1
InChIInChI=1S/C15H18FNO2/c1-2-17-9-13-7-8-14(19-13)11-18-10-12-5-3-4-6-15(12)16/h3-8,17H,2,9-11H2,1H3
InChIKeyLCPRQMLPFABXKE-UHFFFAOYSA-N
MW263.31 g/mol
LogP3.24
Rot. Bonds7

About N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine

N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine (PubChem CID 63935555) has the molecular formula C15H18FNO2 and a molecular weight of 263.31 g/mol. Its IUPAC name is N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine
PubChem CID63935555
Molecular FormulaC15H18FNO2
Molecular Weight263.31 g/mol
Exact Mass263.13
IUPAC NameN-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(COCc2ccccc2F)o1
InChIInChI=1S/C15H18FNO2/c1-2-17-9-13-7-8-14(19-13)11-18-10-12-5-3-4-6-15(12)16/h3-8,17H,2,9-11H2,1H3
InChIKeyLCPRQMLPFABXKE-UHFFFAOYSA-N
XLogP3.24
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine (CID 63935555) is N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine is CCNCc1ccc(COCc2ccccc2F)o1.
What is the InChIKey of N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine?
The InChIKey is LCPRQMLPFABXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO2/c1-2-17-9-13-7-8-14(19-13)11-18-10-12-5-3-4-6-15(12)16/h3-8,17H,2,9-11H2,1H3.
What are the key properties of N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine?
N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine has a molecular weight of 263.31 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]ethanamine is sourced from PubChem (CID 63935555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).