[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane

C14H18N2OSi — CID 46831141

IUPAC[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane
SMILESCOc1cncnc1-c1cccc([Si](C)(C)C)c1
InChIInChI=1S/C14H18N2OSi/c1-17-13-9-15-10-16-14(13)11-6-5-7-12(8-11)18(2,3)4/h5-10H,1-4H3
InChIKeyWITXFRVAMXLHEX-UHFFFAOYSA-N
MW258.40 g/mol
LogP2.70
Rot. Bonds3

About [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane

[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane (PubChem CID 46831141) has the molecular formula C14H18N2OSi and a molecular weight of 258.40 g/mol. Its IUPAC name is [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane.

Molecular Properties

Compound Name[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane
PubChem CID46831141
Molecular FormulaC14H18N2OSi
Molecular Weight258.40 g/mol
Exact Mass258.12
IUPAC Name[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane
SMILESCOc1cncnc1-c1cccc([Si](C)(C)C)c1
InChIInChI=1S/C14H18N2OSi/c1-17-13-9-15-10-16-14(13)11-6-5-7-12(8-11)18(2,3)4/h5-10H,1-4H3
InChIKeyWITXFRVAMXLHEX-UHFFFAOYSA-N
XLogP2.70
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.40
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[3-chloro-4-(trifluoromethoxy)phenyl]-5-methoxypyrimidine
CID 46831438
trimethyl-[3-[4-[3-[4-(3-trimethylsilylphenyl)phenyl]phenyl]phenyl]phenyl]silane
CID 101404035
(3-methoxyphenyl)-trimethylsilane
CID 2760824
4-(3-chlorophenyl)-5-methylpyrimidine
CID 130121120
5,5,5-trifluoro-1-[3-[7-(5-methoxypyrimidin-4-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]pentan-2-one
CID 147786851
4-(2,6-dimethoxyphenoxy)pyrimidin-5-amine
CID 79917584
3-(3-fluorophenyl)-4,5-dimethoxypyridine
CID 174673027
3-(5-methylpyrimidin-4-yl)benzaldehyde
CID 166845050
N-[(2-methoxyphenyl)methyl]-N-methyl-4-phenylpyrimidine-5-carboxamide
CID 122134623
5-(chloromethyl)-4-(3,4,5-trimethoxyphenyl)pyrimidine
CID 18674993
5-[(2,6-dichlorophenyl)methoxy]-2-[5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]phenol
CID 135651610
4-methyl-5-(3-methylphenyl)pyrimidine
CID 178100912

Frequently Asked Questions

What is the IUPAC name of [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane?
The IUPAC name of [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane (CID 46831141) is [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane.
What is the SMILES notation for [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane?
The canonical SMILES for [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane is COc1cncnc1-c1cccc([Si](C)(C)C)c1.
What is the InChIKey of [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane?
The InChIKey is WITXFRVAMXLHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OSi/c1-17-13-9-15-10-16-14(13)11-6-5-7-12(8-11)18(2,3)4/h5-10H,1-4H3.
What are the key properties of [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane?
[3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane has a molecular weight of 258.40 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-methoxypyrimidin-4-yl)phenyl]-trimethylsilane is sourced from PubChem (CID 46831141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).