2-(methyliminomethyl)pyridin-3-ol

C7H8N2O — CID 136948272

IUPAC2-(methyliminomethyl)pyridin-3-ol
SMILESC/N=C/c1ncccc1O
InChIInChI=1S/C7H8N2O/c1-8-5-6-7(10)3-2-4-9-6/h2-5,10H,1H3/b8-5+
InChIKeyLHEVSVQQNPQZFO-VMPITWQZSA-N
MW136.15 g/mol
LogP0.84
Rot. Bonds1

About 2-(methyliminomethyl)pyridin-3-ol

2-(methyliminomethyl)pyridin-3-ol (PubChem CID 136948272) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol. Its IUPAC name is 2-(methyliminomethyl)pyridin-3-ol.

Molecular Properties

Compound Name2-(methyliminomethyl)pyridin-3-ol
PubChem CID136948272
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name2-(methyliminomethyl)pyridin-3-ol
SMILESC/N=C/c1ncccc1O
InChIInChI=1S/C7H8N2O/c1-8-5-6-7(10)3-2-4-9-6/h2-5,10H,1H3/b8-5+
InChIKeyLHEVSVQQNPQZFO-VMPITWQZSA-N
XLogP0.84
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-methoxyiminomethyl]pyridin-3-ol
CID 137012775
2-[(E)-ethoxyiminomethyl]pyridin-3-ol
CID 137274276
2-[(4-phenyldiazenylphenyl)iminomethyl]pyridin-3-ol
CID 136776452
1-(3-ethenyl-2-pyridinyl)-N-methylmethanimine;propane
CID 178116820
2-[(2-hydroxy-1-phenylethyl)iminomethyl]pyridin-3-ol
CID 137254256
4-(3-hydroxy-2-pyridinyl)but-3-en-2-one
CID 69105394
2-(3-hydroxyprop-1-enyl)pyridin-3-ol
CID 169452896
2-(3-aminoprop-1-enyl)pyridin-3-ol
CID 169463141
N-[(3-methyl-2-pyridinyl)methylidene]hydroxylamine
CID 137218431
2-[(3-hydroxy-2-pyridinyl)methylidene]propanedioic acid
CID 901891
N-[3-(3-hydroxy-2-pyridinyl)prop-2-enyl]acetamide
CID 169464929
2-[(E)-(3-hydroxy-2-pyridinyl)diazenyl]pyridin-3-ol
CID 137201296

Frequently Asked Questions

What is the IUPAC name of 2-(methyliminomethyl)pyridin-3-ol?
The IUPAC name of 2-(methyliminomethyl)pyridin-3-ol (CID 136948272) is 2-(methyliminomethyl)pyridin-3-ol.
What is the SMILES notation for 2-(methyliminomethyl)pyridin-3-ol?
The canonical SMILES for 2-(methyliminomethyl)pyridin-3-ol is C/N=C/c1ncccc1O.
What is the InChIKey of 2-(methyliminomethyl)pyridin-3-ol?
The InChIKey is LHEVSVQQNPQZFO-VMPITWQZSA-N. The full InChI is InChI=1S/C7H8N2O/c1-8-5-6-7(10)3-2-4-9-6/h2-5,10H,1H3/b8-5+.
What are the key properties of 2-(methyliminomethyl)pyridin-3-ol?
2-(methyliminomethyl)pyridin-3-ol has a molecular weight of 136.15 g/mol, XLogP of 0.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methyliminomethyl)pyridin-3-ol is sourced from PubChem (CID 136948272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).