2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol

C19H24N2O2 — CID 135595845

IUPAC2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol
SMILESCCOc1cccc(/C=N/C[C@@H](c2ccccc2)N(C)C)c1O
InChIInChI=1S/C19H24N2O2/c1-4-23-18-12-8-11-16(19(18)22)13-20-14-17(21(2)3)15-9-6-5-7-10-15/h5-13,17,22H,4,14H2,1-3H3/b20-13+/t17-/m0/s1
InChIKeyOSSWONJGRQTGOK-NNIWKIFQSA-N
MW312.41 g/mol
LogP3.51
Rot. Bonds7

About 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol

2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol (PubChem CID 135595845) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol.

Molecular Properties

Compound Name2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol
PubChem CID135595845
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol
SMILESCCOc1cccc(/C=N/C[C@@H](c2ccccc2)N(C)C)c1O
InChIInChI=1S/C19H24N2O2/c1-4-23-18-12-8-11-16(19(18)22)13-20-14-17(21(2)3)15-9-6-5-7-10-15/h5-13,17,22H,4,14H2,1-3H3/b20-13+/t17-/m0/s1
InChIKeyOSSWONJGRQTGOK-NNIWKIFQSA-N
XLogP3.51
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethoxy-6-[2-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
CID 135487695
2-ethoxy-6-[(phenylhydrazinylidene)methyl]phenol
CID 169381520
2-ethoxy-6-(phenyliminomethyl)phenol
CID 135657442
2-[(4-anilinophenyl)iminomethyl]-6-ethoxyphenol
CID 135774329
2-[(4-benzhydrylpiperazin-1-yl)iminomethyl]-6-ethoxyphenol
CID 2868303
2-ethoxy-6-[(4-propan-2-ylphenyl)iminomethyl]phenol
CID 135657449
2-ethoxy-6-[(E)-2-[(E)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]oxyethoxyiminomethyl]phenol
CID 139177834
gallium 2-ethoxy-6-[[3-[2-[[3-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]-2,2-dimethylpropyl]amino]ethylamino]-2,2-dimethylpropyl]iminomethyl]phenol
CID 135437988
(2E)-2-[(E)-(3-ethoxy-2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
CID 135736502
N-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 2551534
2-ethoxy-6-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]iminomethyl]phenol
CID 135597885
2-ethoxy-6-[1-(4-fluorophenyl)ethyliminomethyl]phenol
CID 135657510

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol?
The IUPAC name of 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol (CID 135595845) is 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol.
What is the SMILES notation for 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol?
The canonical SMILES for 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol is CCOc1cccc(/C=N/C[C@@H](c2ccccc2)N(C)C)c1O.
What is the InChIKey of 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol?
The InChIKey is OSSWONJGRQTGOK-NNIWKIFQSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-4-23-18-12-8-11-16(19(18)22)13-20-14-17(21(2)3)15-9-6-5-7-10-15/h5-13,17,22H,4,14H2,1-3H3/b20-13+/t17-/m0/s1.
What are the key properties of 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol?
2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol has a molecular weight of 312.41 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-2-(dimethylamino)-2-phenylethyl]iminomethyl]-6-ethoxyphenol is sourced from PubChem (CID 135595845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).