1-(2-fluorophenyl)-N-methoxyethenamine

C9H10FNO — CID 57082075

IUPAC1-(2-fluorophenyl)-N-methoxyethenamine
SMILESC=C(NOC)c1ccccc1F
InChIInChI=1S/C9H10FNO/c1-7(11-12-2)8-5-3-4-6-9(8)10/h3-6,11H,1H2,2H3
InChIKeyFCLDYOUFYSVFGN-UHFFFAOYSA-N
MW167.18 g/mol
LogP1.95
Rot. Bonds3

About 1-(2-fluorophenyl)-N-methoxyethenamine

1-(2-fluorophenyl)-N-methoxyethenamine (PubChem CID 57082075) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-methoxyethenamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-methoxyethenamine
PubChem CID57082075
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name1-(2-fluorophenyl)-N-methoxyethenamine
SMILESC=C(NOC)c1ccccc1F
InChIInChI=1S/C9H10FNO/c1-7(11-12-2)8-5-3-4-6-9(8)10/h3-6,11H,1H2,2H3
InChIKeyFCLDYOUFYSVFGN-UHFFFAOYSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-N-[2-(methoxyamino)-2-oxoethyl]benzamide
CID 60717185
1-[1-(2-fluorophenyl)ethenylamino]-3-(2-methoxyethyl)thiourea
CID 2489635
1-fluoro-2-(1-iodoethenyl)benzene
CID 134999703
N-methoxy-1-(4-phenylphenyl)ethenamine
CID 57139262
2-(2-fluorophenyl)ethene-1,1,2-tricarbonitrile
CID 91181547
3-methoxypropyl 2-fluorobenzoate
CID 63297243
2-amino-1-(2-fluorophenyl)-2-methoxyethanone
CID 57287151
(Z)-1-(2-fluorophenyl)-N-methoxyethanimine
CID 18416418
(Z)-1-(2-fluorophenyl)prop-1-en-1-amine
CID 143204605
3-(2-fluorophenyl)but-2-enenitrile
CID 76913879
methyl 3-[(2-fluorobenzoyl)amino]-2-iodopropanoate
CID 103493166
dimethyl 5-(2-fluorobenzoyl)oxybenzene-1,3-dicarboxylate
CID 2462733

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-methoxyethenamine?
The IUPAC name of 1-(2-fluorophenyl)-N-methoxyethenamine (CID 57082075) is 1-(2-fluorophenyl)-N-methoxyethenamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-methoxyethenamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-methoxyethenamine is C=C(NOC)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N-methoxyethenamine?
The InChIKey is FCLDYOUFYSVFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO/c1-7(11-12-2)8-5-3-4-6-9(8)10/h3-6,11H,1H2,2H3.
What are the key properties of 1-(2-fluorophenyl)-N-methoxyethenamine?
1-(2-fluorophenyl)-N-methoxyethenamine has a molecular weight of 167.18 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-methoxyethenamine is sourced from PubChem (CID 57082075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).