(2-methoxy-5-methyl-3-pyridinyl)astatine

C7H8AtNO — CID 143027956

IUPAC(2-methoxy-5-methyl-3-pyridinyl)astatine
SMILESCOc1ncc(C)cc1[At]
InChIInChI=1S/C7H8AtNO/c1-5-3-6(8)7(10-2)9-4-5/h3-4H,1-2H3
InChIKeyCHFHSMCTKAJDSJ-UHFFFAOYSA-N
MW332.15 g/mol
LogP0.57
Rot. Bonds1

About (2-methoxy-5-methyl-3-pyridinyl)astatine

(2-methoxy-5-methyl-3-pyridinyl)astatine (PubChem CID 143027956) has the molecular formula C7H8AtNO and a molecular weight of 332.15 g/mol. Its IUPAC name is (2-methoxy-5-methyl-3-pyridinyl)astatine.

Molecular Properties

Compound Name(2-methoxy-5-methyl-3-pyridinyl)astatine
PubChem CID143027956
Molecular FormulaC7H8AtNO
Molecular Weight332.15 g/mol
Exact Mass332.05
IUPAC Name(2-methoxy-5-methyl-3-pyridinyl)astatine
SMILESCOc1ncc(C)cc1[At]
InChIInChI=1S/C7H8AtNO/c1-5-3-6(8)7(10-2)9-4-5/h3-4H,1-2H3
InChIKeyCHFHSMCTKAJDSJ-UHFFFAOYSA-N
XLogP0.57
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.15
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-methoxy-5-methylpyridine;methanamine
CID 163239681
2-methoxy-5-methyl-3-phenylpyridine
CID 46315016
methyl 2-methoxy-5-methylpyridine-3-carboxylate
CID 22678367
2-methoxy-5-methylpyridine-3-carboxamide
CID 123709075
2-methoxy-5-methyl-N-(oxetan-3-yl)pyridin-3-amine
CID 130690143
3-bromo-2-(2,5-dibromo-4-methoxyphenoxy)-5-methylpyridine
CID 105368353
2-(3,5-dimethoxyphenoxy)-5-methylpyridin-3-amine
CID 66278697
2-chloro-3-methoxy-5-methylpyridine
CID 46318108
1-(6-methoxy-5-methyl-3-pyridinyl)ethanol
CID 102544501
2-(2-methoxy-5-methyl-3-pyridinyl)-1H-indole
CID 90290279
2-methoxy-5-methyl-3-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]pyridine
CID 74890789
N-(2-methoxy-5-methyl-3-pyridinyl)cyclopentanecarboxamide
CID 71983272

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-5-methyl-3-pyridinyl)astatine?
The IUPAC name of (2-methoxy-5-methyl-3-pyridinyl)astatine (CID 143027956) is (2-methoxy-5-methyl-3-pyridinyl)astatine.
What is the SMILES notation for (2-methoxy-5-methyl-3-pyridinyl)astatine?
The canonical SMILES for (2-methoxy-5-methyl-3-pyridinyl)astatine is COc1ncc(C)cc1[At].
What is the InChIKey of (2-methoxy-5-methyl-3-pyridinyl)astatine?
The InChIKey is CHFHSMCTKAJDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8AtNO/c1-5-3-6(8)7(10-2)9-4-5/h3-4H,1-2H3.
What are the key properties of (2-methoxy-5-methyl-3-pyridinyl)astatine?
(2-methoxy-5-methyl-3-pyridinyl)astatine has a molecular weight of 332.15 g/mol, XLogP of 0.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-5-methyl-3-pyridinyl)astatine is sourced from PubChem (CID 143027956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).