2-fluoro-4-methoxyaniline

C7H8FNO — CID 3756383

IUPAC2-fluoro-4-methoxyaniline
SMILESCOc1ccc(N)c(F)c1
InChIInChI=1S/C7H8FNO/c1-10-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3
InChIKeyYWUVOJJHVFLNJA-UHFFFAOYSA-N
MW141.14 g/mol
LogP1.42
Rot. Bonds1

About 2-fluoro-4-methoxyaniline

2-fluoro-4-methoxyaniline (PubChem CID 3756383) has the molecular formula C7H8FNO and a molecular weight of 141.14 g/mol. Its IUPAC name is 2-fluoro-4-methoxyaniline.

Molecular Properties

Compound Name2-fluoro-4-methoxyaniline
PubChem CID3756383
Molecular FormulaC7H8FNO
Molecular Weight141.14 g/mol
Exact Mass141.06
IUPAC Name2-fluoro-4-methoxyaniline
SMILESCOc1ccc(N)c(F)c1
InChIInChI=1S/C7H8FNO/c1-10-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3
InChIKeyYWUVOJJHVFLNJA-UHFFFAOYSA-N
XLogP1.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 51.42
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

4-[(2-bromo-5-methoxyphenyl)methoxy]-2-fluoroaniline
CID 65322368
2-fluoro-4-[(2-fluoro-4-methoxyphenyl)methylsulfinyl]aniline
CID 102879980
2-fluoro-4-(2,4,6-trimethoxyphenyl)aniline
CID 61025671
2-(2-fluoro-4-methoxyphenyl)-4-(trifluoromethoxy)aniline
CID 172676520
5-(2-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-3-amine
CID 102885475
4-methoxy-2-(trifluoromethyl)aniline
CID 22601721
2-(difluoromethyl)-4-methoxyaniline
CID 45091134
1-fluoro-4-methoxy-2-methylbenzene;methanamine
CID 142516240
1,2-difluoro-4-methoxybenzene;ethane;pentane
CID 144721710
(2-fluoro-4-methoxyphenyl)hydrazine;hydrobromide
CID 138620143
2-(2,6-difluoro-4-methoxyphenyl)-4-methylaniline
CID 54912439
(1R)-2,2-difluoro-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 130665860

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxyaniline?
The IUPAC name of 2-fluoro-4-methoxyaniline (CID 3756383) is 2-fluoro-4-methoxyaniline.
What is the SMILES notation for 2-fluoro-4-methoxyaniline?
The canonical SMILES for 2-fluoro-4-methoxyaniline is COc1ccc(N)c(F)c1.
What is the InChIKey of 2-fluoro-4-methoxyaniline?
The InChIKey is YWUVOJJHVFLNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO/c1-10-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3.
What are the key properties of 2-fluoro-4-methoxyaniline?
2-fluoro-4-methoxyaniline has a molecular weight of 141.14 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxyaniline is sourced from PubChem (CID 3756383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).