CID 159030266

C14H26NSiTi — CID 159030266

IUPAC—
SMILESC[SiH]C.Cc1c[c-](C)c(C)c1C.[NH-]C1CC1.[Ti+2]
InChIInChI=1S/C9H13.C3H6N.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;4-3-1-2-3;1-3-2;/h5H,1-4H3;3-4H,1-2H2;3H,1-2H3;/q2*-1;;+2
InChIKeyXZCHQBKKRXOJFW-UHFFFAOYSA-N
MW284.32 g/mol
LogP4.36
Rot. Bonds

About CID 159030266

CID 159030266 (PubChem CID 159030266) has the molecular formula C14H26NSiTi and a molecular weight of 284.32 g/mol.

Molecular Properties

Compound NameCID 159030266
PubChem CID159030266
Molecular FormulaC14H26NSiTi
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name—
SMILESC[SiH]C.Cc1c[c-](C)c(C)c1C.[NH-]C1CC1.[Ti+2]
InChIInChI=1S/C9H13.C3H6N.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;4-3-1-2-3;1-3-2;/h5H,1-4H3;3-4H,1-2H2;3H,1-2H3;/q2*-1;;+2
InChIKeyXZCHQBKKRXOJFW-UHFFFAOYSA-N
XLogP4.36
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 159030266?
The IUPAC name of CID 159030266 (CID 159030266) is not available.
What is the SMILES notation for CID 159030266?
The canonical SMILES for CID 159030266 is C[SiH]C.Cc1c[c-](C)c(C)c1C.[NH-]C1CC1.[Ti+2].
What is the InChIKey of CID 159030266?
The InChIKey is XZCHQBKKRXOJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13.C3H6N.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;4-3-1-2-3;1-3-2;/h5H,1-4H3;3-4H,1-2H2;3H,1-2H3;/q2*-1;;+2.
What are the key properties of CID 159030266?
CID 159030266 has a molecular weight of 284.32 g/mol, XLogP of 4.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159030266 is sourced from PubChem (CID 159030266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).