CID 22468102

C13H15N6Si — CID 22468102

IUPAC—
SMILESCC1(C([Si])(C2(C)C=CN=N2)C2(C)C=CN=N2)C=CN=N1
InChIInChI=1S/C13H15N6Si/c1-10(4-7-14-17-10)13(20,11(2)5-8-15-18-11)12(3)6-9-16-19-12/h4-9H,1-3H3
InChIKeyIFSMNQNYTPCTTB-UHFFFAOYSA-N
MW283.39 g/mol
LogP3.53
Rot. Bonds3

About CID 22468102

CID 22468102 (PubChem CID 22468102) has the molecular formula C13H15N6Si and a molecular weight of 283.39 g/mol.

Molecular Properties

Compound NameCID 22468102
PubChem CID22468102
Molecular FormulaC13H15N6Si
Molecular Weight283.39 g/mol
Exact Mass283.11
IUPAC Name—
SMILESCC1(C([Si])(C2(C)C=CN=N2)C2(C)C=CN=N2)C=CN=N1
InChIInChI=1S/C13H15N6Si/c1-10(4-7-14-17-10)13(20,11(2)5-8-15-18-11)12(3)6-9-16-19-12/h4-9H,1-3H3
InChIKeyIFSMNQNYTPCTTB-UHFFFAOYSA-N
XLogP3.53
TPSA74.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Tris(3-methylpyrazol-3-yl)methylsilane
CID 173229473

Frequently Asked Questions

What is the IUPAC name of CID 22468102?
The IUPAC name of CID 22468102 (CID 22468102) is not available.
What is the SMILES notation for CID 22468102?
The canonical SMILES for CID 22468102 is CC1(C([Si])(C2(C)C=CN=N2)C2(C)C=CN=N2)C=CN=N1.
What is the InChIKey of CID 22468102?
The InChIKey is IFSMNQNYTPCTTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N6Si/c1-10(4-7-14-17-10)13(20,11(2)5-8-15-18-11)12(3)6-9-16-19-12/h4-9H,1-3H3.
What are the key properties of CID 22468102?
CID 22468102 has a molecular weight of 283.39 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22468102 is sourced from PubChem (CID 22468102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).