CID 11399013

C19H39N3SiU-3 — CID 11399013

IUPAC—
SMILESC[C]1[C](C)[C](C)[C]([Si](C)(C)[N-]C(C)(C)C)[C]1C.C[N-]C.C[N-]C.[U]
InChIInChI=1S/C15H27NSi.2C2H6N.U/c1-10-11(2)13(4)14(12(10)3)17(8,9)16-15(5,6)7;2*1-3-2;/h1-9H3;2*1-2H3;/q3*-1;
InChIKeyZGNOYZUMJOVRII-UHFFFAOYSA-N
MW575.66 g/mol
LogP6.11
Rot. Bonds2

About CID 11399013

CID 11399013 (PubChem CID 11399013) has the molecular formula C19H39N3SiU-3 and a molecular weight of 575.66 g/mol.

Molecular Properties

Compound NameCID 11399013
PubChem CID11399013
Molecular FormulaC19H39N3SiU-3
Molecular Weight575.66 g/mol
Exact Mass575.34
IUPAC Name—
SMILESC[C]1[C](C)[C](C)[C]([Si](C)(C)[N-]C(C)(C)C)[C]1C.C[N-]C.C[N-]C.[U]
InChIInChI=1S/C15H27NSi.2C2H6N.U/c1-10-11(2)13(4)14(12(10)3)17(8,9)16-15(5,6)7;2*1-3-2;/h1-9H3;2*1-2H3;/q3*-1;
InChIKeyZGNOYZUMJOVRII-UHFFFAOYSA-N
XLogP6.11
TPSA42.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500575.66
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 11399013?
The IUPAC name of CID 11399013 (CID 11399013) is not available.
What is the SMILES notation for CID 11399013?
The canonical SMILES for CID 11399013 is C[C]1[C](C)[C](C)[C]([Si](C)(C)[N-]C(C)(C)C)[C]1C.C[N-]C.C[N-]C.[U].
What is the InChIKey of CID 11399013?
The InChIKey is ZGNOYZUMJOVRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NSi.2C2H6N.U/c1-10-11(2)13(4)14(12(10)3)17(8,9)16-15(5,6)7;2*1-3-2;/h1-9H3;2*1-2H3;/q3*-1;.
What are the key properties of CID 11399013?
CID 11399013 has a molecular weight of 575.66 g/mol, XLogP of 6.11, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11399013 is sourced from PubChem (CID 11399013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).