formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde

C10H9N3O2 — CID 175236947

IUPACformaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde
SMILESC=O.O=Cc1cccc(-n2cccn2)n1
InChIInChI=1S/C9H7N3O.CH2O/c13-7-8-3-1-4-9(11-8)12-6-2-5-10-12;1-2/h1-7H;1H2
InChIKeyBXEDZASCNIALET-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.89
Rot. Bonds2

About formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde

formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde (PubChem CID 175236947) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde.

Molecular Properties

Compound Nameformaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde
PubChem CID175236947
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Nameformaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde
SMILESC=O.O=Cc1cccc(-n2cccn2)n1
InChIInChI=1S/C9H7N3O.CH2O/c13-7-8-3-1-4-9(11-8)12-6-2-5-10-12;1-2/h1-7H;1H2
InChIKeyBXEDZASCNIALET-UHFFFAOYSA-N
XLogP0.89
TPSA64.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

cobalt;2,6-di(pyrazol-1-yl)pyridine
CID 175285024
2,6-di(pyrazol-1-yl)pyridine;ethane
CID 161004059
2,6-di(pyrazol-1-yl)pyridine;ethane
CID 144724019
6-(6-formyl-2-pyridinyl)pyridine-2-carbaldehyde
CID 4975903
tetrakis(4-tert-butyl-2,6-di(pyrazol-1-yl)pyridine);bis(cobalt(2+));bis(cobalt(3+));tetrakis(2,6-di(pyrazol-1-yl)pyridine)
CID 158524727
2-(3-methylimidazol-3-ium-1-yl)-6-pyrazol-1-ylpyridine
CID 58130223
N-propyl-6-pyrazol-1-ylpyridin-2-amine
CID 80853586
2-pyrazol-1-yl-6-pyridin-2-yloxypyridine
CID 91616296
2-bromo-2-(6-pyrazol-1-yl-3-pyridinyl)acetaldehyde
CID 174703787
1-(6-formyl-3-pyrazol-1-yl-2-pyridinyl)ethyl methanesulfinate
CID 146639229
2-methyl-N-[(6-pyrazol-1-yl-2-pyridinyl)methyl]propan-2-amine
CID 55059602
3-cyclopropyl-2-[(6-pyrazol-1-ylpyridine-2-carbonyl)amino]propanoic acid
CID 120535926

Frequently Asked Questions

What is the IUPAC name of formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde?
The IUPAC name of formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde (CID 175236947) is formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde.
What is the SMILES notation for formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde?
The canonical SMILES for formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde is C=O.O=Cc1cccc(-n2cccn2)n1.
What is the InChIKey of formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde?
The InChIKey is BXEDZASCNIALET-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O.CH2O/c13-7-8-3-1-4-9(11-8)12-6-2-5-10-12;1-2/h1-7H;1H2.
What are the key properties of formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde?
formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde has a molecular weight of 203.20 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;6-pyrazol-1-ylpyridine-2-carbaldehyde is sourced from PubChem (CID 175236947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).