(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane

C17H19BrN2OSi — CID 86704676

IUPAC(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane
SMILESCOc1ccc2c(Br)c(-c3ccccc3)nn2c1[Si](C)(C)C
InChIInChI=1S/C17H19BrN2OSi/c1-21-14-11-10-13-15(18)16(12-8-6-5-7-9-12)19-20(13)17(14)22(2,3)4/h5-11H,1-4H3
InChIKeyPJNFDLKLJCSQPT-UHFFFAOYSA-N
MW375.34 g/mol
LogP4.32
Rot. Bonds3

About (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane

(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane (PubChem CID 86704676) has the molecular formula C17H19BrN2OSi and a molecular weight of 375.34 g/mol. Its IUPAC name is (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane.

Molecular Properties

Compound Name(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane
PubChem CID86704676
Molecular FormulaC17H19BrN2OSi
Molecular Weight375.34 g/mol
Exact Mass374.05
IUPAC Name(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane
SMILESCOc1ccc2c(Br)c(-c3ccccc3)nn2c1[Si](C)(C)C
InChIInChI=1S/C17H19BrN2OSi/c1-21-14-11-10-13-15(18)16(12-8-6-5-7-9-12)19-20(13)17(14)22(2,3)4/h5-11H,1-4H3
InChIKeyPJNFDLKLJCSQPT-UHFFFAOYSA-N
XLogP4.32
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.34
LogP ≤ 54.32
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

3-bromo-7-(4-methoxypiperidin-1-yl)-2-phenylpyrazolo[1,5-c]pyrimidine
CID 122655925
2-bromo-3-methoxy-6-phenylpyridine
CID 10869126
3-bromo-5-phenyl-2-(4-phenylphenyl)pyrazolo[1,5-a]pyridine
CID 142726284
3-(5-bromo-2-methoxyphenyl)-6,7-diphenyl-[1,2,4]triazolo[4,3-b][1,2,4]triazine
CID 117058479
3-bromo-2-(3-methoxyphenyl)pyrazolo[1,5-a]pyridine
CID 139886725
6,7-dimethoxy-2,3-diphenylquinoxaline
CID 1236458
5-[2,6-dimethoxy-5-(3-methyl-5-phenyltriazol-4-yl)naphthalen-1-yl]-1-methyl-4-phenyltriazole
CID 154717351
8-bromo-2,4-diethyl-7-phenylpyrazolo[1,5-a][1,3,5]triazine
CID 12916112
ethyl 3-bromo-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylate
CID 12511238
3-(3,4-dimethoxyphenyl)-5-(4-phenylphenyl)-1,2,4-oxadiazole
CID 8895210
(6-chloro-2-phenyl-7-trimethylsilylpyrazolo[1,5-a]pyridin-3-yl)-[6-[2-(methoxymethoxy)phenyl]sulfanyl-2-pyridinyl]methanol
CID 86704808
5-chloro-6-methoxy-3-phenyl-1,2-benzoxazole
CID 15084637

Frequently Asked Questions

What is the IUPAC name of (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane?
The IUPAC name of (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane (CID 86704676) is (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane.
What is the SMILES notation for (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane?
The canonical SMILES for (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane is COc1ccc2c(Br)c(-c3ccccc3)nn2c1[Si](C)(C)C.
What is the InChIKey of (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane?
The InChIKey is PJNFDLKLJCSQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrN2OSi/c1-21-14-11-10-13-15(18)16(12-8-6-5-7-9-12)19-20(13)17(14)22(2,3)4/h5-11H,1-4H3.
What are the key properties of (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane?
(3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane has a molecular weight of 375.34 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-6-methoxy-2-phenylpyrazolo[1,5-a]pyridin-7-yl)-trimethylsilane is sourced from PubChem (CID 86704676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).