[2-(2-fluoroethoxy)-6-methylphenyl]methanamine

C10H14FNO — CID 59567172

IUPAC[2-(2-fluoroethoxy)-6-methylphenyl]methanamine
SMILESCc1cccc(OCCF)c1CN
InChIInChI=1S/C10H14FNO/c1-8-3-2-4-10(9(8)7-12)13-6-5-11/h2-4H,5-7,12H2,1H3
InChIKeyWYRVFIGSAMCORO-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.80
Rot. Bonds4

About [2-(2-fluoroethoxy)-6-methylphenyl]methanamine

[2-(2-fluoroethoxy)-6-methylphenyl]methanamine (PubChem CID 59567172) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is [2-(2-fluoroethoxy)-6-methylphenyl]methanamine.

Molecular Properties

Compound Name[2-(2-fluoroethoxy)-6-methylphenyl]methanamine
PubChem CID59567172
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name[2-(2-fluoroethoxy)-6-methylphenyl]methanamine
SMILESCc1cccc(OCCF)c1CN
InChIInChI=1S/C10H14FNO/c1-8-3-2-4-10(9(8)7-12)13-6-5-11/h2-4H,5-7,12H2,1H3
InChIKeyWYRVFIGSAMCORO-UHFFFAOYSA-N
XLogP1.80
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoroethoxy)-6-methylphenyl]methanamine?
The IUPAC name of [2-(2-fluoroethoxy)-6-methylphenyl]methanamine (CID 59567172) is [2-(2-fluoroethoxy)-6-methylphenyl]methanamine.
What is the SMILES notation for [2-(2-fluoroethoxy)-6-methylphenyl]methanamine?
The canonical SMILES for [2-(2-fluoroethoxy)-6-methylphenyl]methanamine is Cc1cccc(OCCF)c1CN.
What is the InChIKey of [2-(2-fluoroethoxy)-6-methylphenyl]methanamine?
The InChIKey is WYRVFIGSAMCORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-8-3-2-4-10(9(8)7-12)13-6-5-11/h2-4H,5-7,12H2,1H3.
What are the key properties of [2-(2-fluoroethoxy)-6-methylphenyl]methanamine?
[2-(2-fluoroethoxy)-6-methylphenyl]methanamine has a molecular weight of 183.23 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoroethoxy)-6-methylphenyl]methanamine is sourced from PubChem (CID 59567172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).