1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol

C18H14FNO — CID 135595992

IUPAC1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/Cc1ccccc1F
InChIInChI=1S/C18H14FNO/c19-17-8-4-2-6-14(17)11-20-12-16-15-7-3-1-5-13(15)9-10-18(16)21/h1-10,12,21H,11H2/b20-12+
InChIKeyXZWOWHQIJSCJCM-UDWIEESQSA-N
MW279.31 g/mol
LogP4.30
Rot. Bonds3

About 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol

1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol (PubChem CID 135595992) has the molecular formula C18H14FNO and a molecular weight of 279.31 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol
PubChem CID135595992
Molecular FormulaC18H14FNO
Molecular Weight279.31 g/mol
Exact Mass279.11
IUPAC Name1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/Cc1ccccc1F
InChIInChI=1S/C18H14FNO/c19-17-8-4-2-6-14(17)11-20-12-16-15-7-3-1-5-13(15)9-10-18(16)21/h1-10,12,21H,11H2/b20-12+
InChIKeyXZWOWHQIJSCJCM-UDWIEESQSA-N
XLogP4.30
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-Hydroxyphenyliminomethyl)-2-naphthol
CID 269970
1-(((2-Hydroxyphenyl)imino)methyl)-2-naphthalenol
CID 85895
1-Cyclohexyliminomethyl-naphthalen-2-ol
CID 598370
1-Naphthalenecarboxaldehyde, 2-hydroxy-, [(2-hydroxy-1-naphthalenyl)methylene]hydrazone
CID 135444602
1-(Anilinomethylidene)-2-naphthalenone
CID 269969
2-Naphthalenol, 1-[[(phenylmethyl)imino]methyl]-
CID 511504
2~3~-[(E)-(Hydroxyimino)methyl][1~1~,2~1~:2~2~,3~1~-Terphenyl]-1~4~,2~4~,3~4~-Triol
CID 135567289
1-(Aminomethyl)naphthalen-2-ol
CID 241200
1-{[Benzyl(methyl)amino]methyl}-2-naphthol
CID 577695
2-Hydroxy-1-naphthaldehyde oxime
CID 135400485
1-{(E)-[(4-vinylphenyl)imino]methyl}-2-naphthol
CID 4445693
2-fluoro-4-[4-[(E)-hydroxyiminomethyl]naphthalen-1-yl]phenol
CID 135436560

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol?
The IUPAC name of 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol (CID 135595992) is 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol?
The canonical SMILES for 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol is Oc1ccc2ccccc2c1/C=N/Cc1ccccc1F.
What is the InChIKey of 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol?
The InChIKey is XZWOWHQIJSCJCM-UDWIEESQSA-N. The full InChI is InChI=1S/C18H14FNO/c19-17-8-4-2-6-14(17)11-20-12-16-15-7-3-1-5-13(15)9-10-18(16)21/h1-10,12,21H,11H2/b20-12+.
What are the key properties of 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol?
1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol has a molecular weight of 279.31 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol is sourced from PubChem (CID 135595992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).