2-[(E)-ethoxyiminomethyl]pyridin-3-ol

C8H10N2O2 — CID 137274276

IUPAC2-[(E)-ethoxyiminomethyl]pyridin-3-ol
SMILESCCO/N=C/c1ncccc1O
InChIInChI=1S/C8H10N2O2/c1-2-12-10-6-7-8(11)4-3-5-9-7/h3-6,11H,2H2,1H3/b10-6+
InChIKeyVHJWYRZTEMSXIU-UXBLZVDNSA-N
MW166.18 g/mol
LogP1.16
Rot. Bonds3

About 2-[(E)-ethoxyiminomethyl]pyridin-3-ol

2-[(E)-ethoxyiminomethyl]pyridin-3-ol (PubChem CID 137274276) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-[(E)-ethoxyiminomethyl]pyridin-3-ol.

Molecular Properties

Compound Name2-[(E)-ethoxyiminomethyl]pyridin-3-ol
PubChem CID137274276
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name2-[(E)-ethoxyiminomethyl]pyridin-3-ol
SMILESCCO/N=C/c1ncccc1O
InChIInChI=1S/C8H10N2O2/c1-2-12-10-6-7-8(11)4-3-5-9-7/h3-6,11H,2H2,1H3/b10-6+
InChIKeyVHJWYRZTEMSXIU-UXBLZVDNSA-N
XLogP1.16
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-methoxyiminomethyl]pyridin-3-ol
CID 137012775
2-(methyliminomethyl)pyridin-3-ol
CID 136948272
2-[(2-hydroxy-1-phenylethyl)iminomethyl]pyridin-3-ol
CID 137254256
ethyl 4-(3-hydroxy-2-pyridinyl)but-3-enoate
CID 170795623
2-[(4-phenyldiazenylphenyl)iminomethyl]pyridin-3-ol
CID 136776452
5-(ethoxyiminomethyl)benzene-1,2,3-triol
CID 136660682
2-(3-hydroxyprop-1-enyl)pyridin-3-ol
CID 169452896
4-chloro-2-[(E)-ethoxyiminomethyl]phenol
CID 135674625
(E)-N-ethoxy-1-(2-ethoxyphenyl)methanimine
CID 134892743
2-(3-aminoprop-1-enyl)pyridin-3-ol
CID 169463141
1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane
CID 178116820
(E)-N-ethoxy-1-(2-methylphenyl)methanimine
CID 88956534

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-ethoxyiminomethyl]pyridin-3-ol?
The IUPAC name of 2-[(E)-ethoxyiminomethyl]pyridin-3-ol (CID 137274276) is 2-[(E)-ethoxyiminomethyl]pyridin-3-ol.
What is the SMILES notation for 2-[(E)-ethoxyiminomethyl]pyridin-3-ol?
The canonical SMILES for 2-[(E)-ethoxyiminomethyl]pyridin-3-ol is CCO/N=C/c1ncccc1O.
What is the InChIKey of 2-[(E)-ethoxyiminomethyl]pyridin-3-ol?
The InChIKey is VHJWYRZTEMSXIU-UXBLZVDNSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-2-12-10-6-7-8(11)4-3-5-9-7/h3-6,11H,2H2,1H3/b10-6+.
What are the key properties of 2-[(E)-ethoxyiminomethyl]pyridin-3-ol?
2-[(E)-ethoxyiminomethyl]pyridin-3-ol has a molecular weight of 166.18 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-ethoxyiminomethyl]pyridin-3-ol is sourced from PubChem (CID 137274276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).