N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine

C14H14FNO — CID 86761305

IUPACN-[(2-fluorophenyl)methoxy]-1-phenylmethanamine
SMILESFc1ccccc1CONCc1ccccc1
InChIInChI=1S/C14H14FNO/c15-14-9-5-4-8-13(14)11-17-16-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKeyDVDOKYMOIVKBJX-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.05
Rot. Bonds5

About N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine

N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine (PubChem CID 86761305) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methoxy]-1-phenylmethanamine
PubChem CID86761305
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC NameN-[(2-fluorophenyl)methoxy]-1-phenylmethanamine
SMILESFc1ccccc1CONCc1ccccc1
InChIInChI=1S/C14H14FNO/c15-14-9-5-4-8-13(14)11-17-16-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKeyDVDOKYMOIVKBJX-UHFFFAOYSA-N
XLogP3.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine?
The IUPAC name of N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine (CID 86761305) is N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine.
What is the SMILES notation for N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine?
The canonical SMILES for N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine is Fc1ccccc1CONCc1ccccc1.
What is the InChIKey of N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine?
The InChIKey is DVDOKYMOIVKBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c15-14-9-5-4-8-13(14)11-17-16-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2.
What are the key properties of N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine?
N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine has a molecular weight of 231.27 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methoxy]-1-phenylmethanamine is sourced from PubChem (CID 86761305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).