CID 21470845

C10H12N3Si — CID 21470845

IUPAC
SMILES[H]/N=C1\N=C(N)c2c1cccc2[Si](C)C
InChIInChI=1S/C10H12N3Si/c1-14(2)7-5-3-4-6-8(7)10(12)13-9(6)11/h3-5H,1-2H3,(H3,11,12,13)
InChIKeyZCSWSLMEWKYIBZ-UHFFFAOYSA-N
MW202.31 g/mol
LogP0.69
Rot. Bonds1

About CID 21470845

CID 21470845 (PubChem CID 21470845) has the molecular formula C10H12N3Si and a molecular weight of 202.31 g/mol.

Molecular Properties

Compound NameCID 21470845
PubChem CID21470845
Molecular FormulaC10H12N3Si
Molecular Weight202.31 g/mol
Exact Mass202.08
IUPAC Name
SMILES[H]/N=C1\N=C(N)c2c1cccc2[Si](C)C
InChIInChI=1S/C10H12N3Si/c1-14(2)7-5-3-4-6-8(7)10(12)13-9(6)11/h3-5H,1-2H3,(H3,11,12,13)
InChIKeyZCSWSLMEWKYIBZ-UHFFFAOYSA-N
XLogP0.69
TPSA62.23 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.31
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 21470845?
The IUPAC name of CID 21470845 (CID 21470845) is not available.
What is the SMILES notation for CID 21470845?
The canonical SMILES for CID 21470845 is [H]/N=C1\N=C(N)c2c1cccc2[Si](C)C.
What is the InChIKey of CID 21470845?
The InChIKey is ZCSWSLMEWKYIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N3Si/c1-14(2)7-5-3-4-6-8(7)10(12)13-9(6)11/h3-5H,1-2H3,(H3,11,12,13).
What are the key properties of CID 21470845?
CID 21470845 has a molecular weight of 202.31 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 21470845 is sourced from PubChem (CID 21470845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).