1-(5-trimethylstannyl-3-pyridinyl)propan-2-one

C11H17NOSn — CID 18718064

IUPAC1-(5-trimethylstannyl-3-pyridinyl)propan-2-one
SMILESCC(=O)Cc1cncc([Sn](C)(C)C)c1
InChIInChI=1S/C8H8NO.3CH3.Sn/c1-7(10)5-8-3-2-4-9-6-8;;;;/h3-4,6H,5H2,1H3;3*1H3;
InChIKeyHTDLOEOCCCMMMD-UHFFFAOYSA-N
MW297.97 g/mol
LogP1.76
Rot. Bonds3

About 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one

1-(5-trimethylstannyl-3-pyridinyl)propan-2-one (PubChem CID 18718064) has the molecular formula C11H17NOSn and a molecular weight of 297.97 g/mol. Its IUPAC name is 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one.

Molecular Properties

Compound Name1-(5-trimethylstannyl-3-pyridinyl)propan-2-one
PubChem CID18718064
Molecular FormulaC11H17NOSn
Molecular Weight297.97 g/mol
Exact Mass299.03
IUPAC Name1-(5-trimethylstannyl-3-pyridinyl)propan-2-one
SMILESCC(=O)Cc1cncc([Sn](C)(C)C)c1
InChIInChI=1S/C8H8NO.3CH3.Sn/c1-7(10)5-8-3-2-4-9-6-8;;;;/h3-4,6H,5H2,1H3;3*1H3;
InChIKeyHTDLOEOCCCMMMD-UHFFFAOYSA-N
XLogP1.76
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.97
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-5-(2-oxopropyl)pyridine-3-carboxylic acid
CID 174862227
5-(2,3-dioxobutyl)pyridine-3-carboxamide
CID 164952929
1-[4-methyl-3,5-bis(2-oxopropyl)phenyl]propan-2-one
CID 66898502
1-(3,4,5-trihydroxyphenyl)propan-2-one
CID 55250541
1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one
CID 83877089
1-(4-ethyl-3-pyridinyl)propan-2-one
CID 83826723
benzene;1-phenylpropan-2-one
CID 21430852
2-(5-methylsulfonyl-3-pyridinyl)acetamide
CID 67982588
methyl 2-(5-chloro-3-pyridinyl)acetate
CID 91594815
1-(4-ethyl-3-fluorophenyl)propan-2-one
CID 118824683
2-(5-amino-3-pyridinyl)acetyl fluoride
CID 143433366
4-(5-methoxy-3-pyridinyl)butan-2-one
CID 69229885

Frequently Asked Questions

What is the IUPAC name of 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one?
The IUPAC name of 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one (CID 18718064) is 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one.
What is the SMILES notation for 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one?
The canonical SMILES for 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one is CC(=O)Cc1cncc([Sn](C)(C)C)c1.
What is the InChIKey of 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one?
The InChIKey is HTDLOEOCCCMMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8NO.3CH3.Sn/c1-7(10)5-8-3-2-4-9-6-8;;;;/h3-4,6H,5H2,1H3;3*1H3;.
What are the key properties of 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one?
1-(5-trimethylstannyl-3-pyridinyl)propan-2-one has a molecular weight of 297.97 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-trimethylstannyl-3-pyridinyl)propan-2-one is sourced from PubChem (CID 18718064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).