N-methyl-N,9-bis(trimethylsilyl)purin-6-amine

C12H23N5Si2 — CID 58834014

IUPACN-methyl-N,9-bis(trimethylsilyl)purin-6-amine
SMILESCN(c1ncnc2c1ncn2[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H23N5Si2/c1-16(18(2,3)4)11-10-12(14-8-13-11)17(9-15-10)19(5,6)7/h8-9H,1-7H3
InChIKeyQUFIYYHDESVHAM-UHFFFAOYSA-N
MW293.52 g/mol
LogP2.78
Rot. Bonds3

About N-methyl-N,9-bis(trimethylsilyl)purin-6-amine

N-methyl-N,9-bis(trimethylsilyl)purin-6-amine (PubChem CID 58834014) has the molecular formula C12H23N5Si2 and a molecular weight of 293.52 g/mol. Its IUPAC name is N-methyl-N,9-bis(trimethylsilyl)purin-6-amine.

Molecular Properties

Compound NameN-methyl-N,9-bis(trimethylsilyl)purin-6-amine
PubChem CID58834014
Molecular FormulaC12H23N5Si2
Molecular Weight293.52 g/mol
Exact Mass293.15
IUPAC NameN-methyl-N,9-bis(trimethylsilyl)purin-6-amine
SMILESCN(c1ncnc2c1ncn2[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H23N5Si2/c1-16(18(2,3)4)11-10-12(14-8-13-11)17(9-15-10)19(5,6)7/h8-9H,1-7H3
InChIKeyQUFIYYHDESVHAM-UHFFFAOYSA-N
XLogP2.78
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.52
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-methyl-N,9-bis(trimethylsilyl)purin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N,9-bis(trimethylsilyl)purin-6-amine?
The IUPAC name of N-methyl-N,9-bis(trimethylsilyl)purin-6-amine (CID 58834014) is N-methyl-N,9-bis(trimethylsilyl)purin-6-amine.
What is the SMILES notation for N-methyl-N,9-bis(trimethylsilyl)purin-6-amine?
The canonical SMILES for N-methyl-N,9-bis(trimethylsilyl)purin-6-amine is CN(c1ncnc2c1ncn2[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of N-methyl-N,9-bis(trimethylsilyl)purin-6-amine?
The InChIKey is QUFIYYHDESVHAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5Si2/c1-16(18(2,3)4)11-10-12(14-8-13-11)17(9-15-10)19(5,6)7/h8-9H,1-7H3.
What are the key properties of N-methyl-N,9-bis(trimethylsilyl)purin-6-amine?
N-methyl-N,9-bis(trimethylsilyl)purin-6-amine has a molecular weight of 293.52 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N,9-bis(trimethylsilyl)purin-6-amine is sourced from PubChem (CID 58834014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).