2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline

C15H16FNO — CID 62058212

IUPAC2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline
SMILESCc1cc(C)c(OCc2ccccc2F)c(N)c1
InChIInChI=1S/C15H16FNO/c1-10-7-11(2)15(14(17)8-10)18-9-12-5-3-4-6-13(12)16/h3-8H,9,17H2,1-2H3
InChIKeyUZWXTQIPAWRHHY-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.60
Rot. Bonds3

About 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline

2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline (PubChem CID 62058212) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline
PubChem CID62058212
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline
SMILESCc1cc(C)c(OCc2ccccc2F)c(N)c1
InChIInChI=1S/C15H16FNO/c1-10-7-11(2)15(14(17)8-10)18-9-12-5-3-4-6-13(12)16/h3-8H,9,17H2,1-2H3
InChIKeyUZWXTQIPAWRHHY-UHFFFAOYSA-N
XLogP3.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 39247930
2-[(2-fluorophenyl)methoxy]-5-methylpyridin-3-amine
CID 66278256
3-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 112648486
[4-[(2-fluorophenyl)methoxy]-3,5-dimethylphenyl]methanol
CID 28933284
3-fluoro-2-[(2-fluorophenyl)methoxy]aniline
CID 113458208
4-[(2-fluorophenyl)methoxy]-3,5-dimethylbenzoic acid
CID 28932941
3,4-difluoro-2-[(2-fluorophenyl)methoxy]aniline
CID 63933644
2-[2-[(2-fluorophenyl)methoxy]-3-methylphenyl]ethanamine
CID 112614778
3,5-dimethyl-2-(2-phenoxyethoxy)aniline
CID 54853263
3,5-dimethyl-2-(phenylmethoxymethoxy)aniline
CID 102939310
3-[(2-fluorophenyl)methoxy]-2-(furan-2-yl)-6,8-dimethylchromen-4-one
CID 1413307
2-[(2-chloro-3-fluorophenyl)methoxy]-3-methylaniline
CID 112651692

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline (CID 62058212) is 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline is Cc1cc(C)c(OCc2ccccc2F)c(N)c1.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline?
The InChIKey is UZWXTQIPAWRHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-10-7-11(2)15(14(17)8-10)18-9-12-5-3-4-6-13(12)16/h3-8H,9,17H2,1-2H3.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline?
2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline has a molecular weight of 245.30 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-3,5-dimethylaniline is sourced from PubChem (CID 62058212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).