2-(cyclopropyliminomethyl)phenol

C10H11NO — CID 5242286

IUPAC2-(cyclopropyliminomethyl)phenol
SMILESOc1ccccc1/C=N/C1CC1
InChIInChI=1S/C10H11NO/c12-10-4-2-1-3-8(10)7-11-9-5-6-9/h1-4,7,9,12H,5-6H2/b11-7+
InChIKeyQTTGFXKYLVDEOB-YRNVUSSQSA-N
MW161.20 g/mol
LogP1.97
Rot. Bonds2

About 2-(cyclopropyliminomethyl)phenol

2-(cyclopropyliminomethyl)phenol (PubChem CID 5242286) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-(cyclopropyliminomethyl)phenol.

Molecular Properties

Compound Name2-(cyclopropyliminomethyl)phenol
PubChem CID5242286
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name2-(cyclopropyliminomethyl)phenol
SMILESOc1ccccc1/C=N/C1CC1
InChIInChI=1S/C10H11NO/c12-10-4-2-1-3-8(10)7-11-9-5-6-9/h1-4,7,9,12H,5-6H2/b11-7+
InChIKeyQTTGFXKYLVDEOB-YRNVUSSQSA-N
XLogP1.97
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.97
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

2-[(1,1-dioxothiolan-3-yl)iminomethyl]phenol
CID 5150731
2-[[(3R)-1,1-dioxothiolan-3-yl]iminomethyl]phenol
CID 2407869
2-[[2-[(2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;nickel
CID 135987838
copper;2-[[(1S,2S)-2-[(2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol
CID 135501676
bis(2-[[4-[(2,3-dihydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]-6-hydroxyphenolate);2-hydroxy-6-[[4-[(3-hydroxy-2-oxidophenyl)methylideneamino]cyclohexyl]iminomethyl]phenolate;titanium
CID 135987887
copper;bis(2-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)iminomethyl]phenol)
CID 5127710
2-[[3-[(2-hydroxy-5-phenylphenyl)methylideneamino]cyclopentyl]iminomethyl]-4-phenylphenol
CID 137159907
2-[(E)-fluoroiminomethyl]phenol
CID 137273576
2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol;vanadium;hydrate
CID 171376264
chromium;bis(2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol);hydrate
CID 139236258
4-bromo-2-[(4-hydroxycyclohexyl)iminomethyl]phenol
CID 135595528
2-[[(1S,2S)-2-cyclopentylcyclopentyl]iminomethyl]phenol
CID 135513792

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropyliminomethyl)phenol?
The IUPAC name of 2-(cyclopropyliminomethyl)phenol (CID 5242286) is 2-(cyclopropyliminomethyl)phenol.
What is the SMILES notation for 2-(cyclopropyliminomethyl)phenol?
The canonical SMILES for 2-(cyclopropyliminomethyl)phenol is Oc1ccccc1/C=N/C1CC1.
What is the InChIKey of 2-(cyclopropyliminomethyl)phenol?
The InChIKey is QTTGFXKYLVDEOB-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H11NO/c12-10-4-2-1-3-8(10)7-11-9-5-6-9/h1-4,7,9,12H,5-6H2/b11-7+.
What are the key properties of 2-(cyclopropyliminomethyl)phenol?
2-(cyclopropyliminomethyl)phenol has a molecular weight of 161.20 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropyliminomethyl)phenol is sourced from PubChem (CID 5242286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).