1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide

C7H10INO — CID 87265017

IUPAC1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide
SMILESCN1C=CC=CC1C=O.I
InChIInChI=1S/C7H9NO.HI/c1-8-5-3-2-4-7(8)6-9;/h2-7H,1H3;1H
InChIKeyYALFRJYYBXBBOM-UHFFFAOYSA-N
MW251.07 g/mol
LogP1.19
Rot. Bonds1

About 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide

1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide (PubChem CID 87265017) has the molecular formula C7H10INO and a molecular weight of 251.07 g/mol. Its IUPAC name is 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide.

Molecular Properties

Compound Name1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide
PubChem CID87265017
Molecular FormulaC7H10INO
Molecular Weight251.07 g/mol
Exact Mass250.98
IUPAC Name1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide
SMILESCN1C=CC=CC1C=O.I
InChIInChI=1S/C7H9NO.HI/c1-8-5-3-2-4-7(8)6-9;/h2-7H,1H3;1H
InChIKeyYALFRJYYBXBBOM-UHFFFAOYSA-N
XLogP1.19
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.07
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl pyridine aldehyde
CID 426973
1-propyl-2H-pyridine-2-carbaldehyde
CID 88210778
6-methoxy-1-methyl-2H-pyridine-2-carbaldehyde
CID 131734644
(3Z,5E)-2-(dimethylamino)-6-[ethenyl(methyl)amino]hexa-3,5-dienal
CID 134182098
1-ethyl-2H-pyridine-2-carbaldehyde
CID 141114392
1-ethenyl-2H-pyridine-2-carbaldehyde
CID 151499598
1-bromo-2H-pyridine-2-carbaldehyde
CID 151746914
5-(dimethylamino)-1-methyl-2H-pyridine-2-carbaldehyde
CID 156217480
1,5-dimethyl-2H-pyridine-2-carbaldehyde
CID 169697498
4H-quinolizine-4-carbaldehyde
CID 174258355
hydron;4H-quinolizine-4-carbaldehyde
CID 174554638
1,2-Dimethylpyridine-2-carbaldehyde
CID 174622494

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide?
The IUPAC name of 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide (CID 87265017) is 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide.
What is the SMILES notation for 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide?
The canonical SMILES for 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide is CN1C=CC=CC1C=O.I.
What is the InChIKey of 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide?
The InChIKey is YALFRJYYBXBBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO.HI/c1-8-5-3-2-4-7(8)6-9;/h2-7H,1H3;1H.
What are the key properties of 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide?
1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide has a molecular weight of 251.07 g/mol, XLogP of 1.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2H-pyridine-2-carbaldehyde;hydroiodide is sourced from PubChem (CID 87265017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).