[4-fluoro-3-(methylideneamino)phenyl]methanol

C8H8FNO — CID 143727816

IUPAC[4-fluoro-3-(methylideneamino)phenyl]methanol
SMILESC=Nc1cc(CO)ccc1F
InChIInChI=1S/C8H8FNO/c1-10-8-4-6(5-11)2-3-7(8)9/h2-4,11H,1,5H2
InChIKeyDCLFMJBKJBFZSI-UHFFFAOYSA-N
MW153.16 g/mol
LogP1.65
Rot. Bonds2

About [4-fluoro-3-(methylideneamino)phenyl]methanol

[4-fluoro-3-(methylideneamino)phenyl]methanol (PubChem CID 143727816) has the molecular formula C8H8FNO and a molecular weight of 153.16 g/mol. Its IUPAC name is [4-fluoro-3-(methylideneamino)phenyl]methanol.

Molecular Properties

Compound Name[4-fluoro-3-(methylideneamino)phenyl]methanol
PubChem CID143727816
Molecular FormulaC8H8FNO
Molecular Weight153.16 g/mol
Exact Mass153.06
IUPAC Name[4-fluoro-3-(methylideneamino)phenyl]methanol
SMILESC=Nc1cc(CO)ccc1F
InChIInChI=1S/C8H8FNO/c1-10-8-4-6(5-11)2-3-7(8)9/h2-4,11H,1,5H2
InChIKeyDCLFMJBKJBFZSI-UHFFFAOYSA-N
XLogP1.65
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.16
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-fluoro-3-(methylideneamino)phenyl]methanol?
The IUPAC name of [4-fluoro-3-(methylideneamino)phenyl]methanol (CID 143727816) is [4-fluoro-3-(methylideneamino)phenyl]methanol.
What is the SMILES notation for [4-fluoro-3-(methylideneamino)phenyl]methanol?
The canonical SMILES for [4-fluoro-3-(methylideneamino)phenyl]methanol is C=Nc1cc(CO)ccc1F.
What is the InChIKey of [4-fluoro-3-(methylideneamino)phenyl]methanol?
The InChIKey is DCLFMJBKJBFZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO/c1-10-8-4-6(5-11)2-3-7(8)9/h2-4,11H,1,5H2.
What are the key properties of [4-fluoro-3-(methylideneamino)phenyl]methanol?
[4-fluoro-3-(methylideneamino)phenyl]methanol has a molecular weight of 153.16 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-fluoro-3-(methylideneamino)phenyl]methanol is sourced from PubChem (CID 143727816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).