(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane

C12H18Ge2N4O3 — CID 3086949

IUPAC(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane
SMILESCc1cc(C)n(C[Ge](=O)O[Ge](=O)Cn2nc(C)cc2C)n1
InChIInChI=1S/C12H18Ge2N4O3/c1-9-5-11(3)17(15-9)7-13(19)21-14(20)8-18-12(4)6-10(2)16-18/h5-6H,7-8H2,1-4H3
InChIKeyRSKBBGGSICFFMS-UHFFFAOYSA-N
MW411.52 g/mol
LogP0.95
Rot. Bonds6

About (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane

(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane (PubChem CID 3086949) has the molecular formula C12H18Ge2N4O3 and a molecular weight of 411.52 g/mol. Its IUPAC name is (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane.

Molecular Properties

Compound Name(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane
PubChem CID3086949
Molecular FormulaC12H18Ge2N4O3
Molecular Weight411.52 g/mol
Exact Mass413.98
IUPAC Name(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane
SMILESCc1cc(C)n(C[Ge](=O)O[Ge](=O)Cn2nc(C)cc2C)n1
InChIInChI=1S/C12H18Ge2N4O3/c1-9-5-11(3)17(15-9)7-13(19)21-14(20)8-18-12(4)6-10(2)16-18/h5-6H,7-8H2,1-4H3
InChIKeyRSKBBGGSICFFMS-UHFFFAOYSA-N
XLogP0.95
TPSA79.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.52
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane?
The IUPAC name of (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane (CID 3086949) is (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane.
What is the SMILES notation for (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane?
The canonical SMILES for (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane is Cc1cc(C)n(C[Ge](=O)O[Ge](=O)Cn2nc(C)cc2C)n1.
What is the InChIKey of (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane?
The InChIKey is RSKBBGGSICFFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18Ge2N4O3/c1-9-5-11(3)17(15-9)7-13(19)21-14(20)8-18-12(4)6-10(2)16-18/h5-6H,7-8H2,1-4H3.
What are the key properties of (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane?
(3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane has a molecular weight of 411.52 g/mol, XLogP of 0.95, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylpyrazol-1-yl)methyl-[(3,5-dimethylpyrazol-1-yl)methyl-oxogermyl]oxy-oxogermane is sourced from PubChem (CID 3086949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).