tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene

C15H29NSiTi — CID 151391574

IUPACtert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene
SMILESCC(C)(C)[NH-].C[Si](C)=[Ti+2].Cc1c[c-](C)c(C)c1C
InChIInChI=1S/C9H13.C4H10N.C2H6Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;/h5H,1-4H3;5H,1-3H3;1-2H3;/q2*-1;;+2
InChIKeySROHZWKMQFRMJG-UHFFFAOYSA-N
MW299.36 g/mol
LogP5.26
Rot. Bonds

About tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene

tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene (PubChem CID 151391574) has the molecular formula C15H29NSiTi and a molecular weight of 299.36 g/mol. Its IUPAC name is tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene.

Molecular Properties

Compound Nametert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene
PubChem CID151391574
Molecular FormulaC15H29NSiTi
Molecular Weight299.36 g/mol
Exact Mass299.15
IUPAC Nametert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene
SMILESCC(C)(C)[NH-].C[Si](C)=[Ti+2].Cc1c[c-](C)c(C)c1C
InChIInChI=1S/C9H13.C4H10N.C2H6Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;/h5H,1-4H3;5H,1-3H3;1-2H3;/q2*-1;;+2
InChIKeySROHZWKMQFRMJG-UHFFFAOYSA-N
XLogP5.26
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.36
LogP ≤ 55.26
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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Related Compounds

CID 88077974
CID 88077974
CID 141582144
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CID 149960533
CID 149960533
CID 149976109
CID 149976109
CID 150958028
CID 150958028
CID 151578075
CID 151578075
CID 151637468
CID 151637468
CID 151993842
CID 151993842
CID 152058492
CID 152058492
CID 152275067
CID 152275067
CID 152416451
CID 152416451
CID 152753145
CID 152753145

Frequently Asked Questions

What is the IUPAC name of tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene?
The IUPAC name of tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene (CID 151391574) is tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene.
What is the SMILES notation for tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene?
The canonical SMILES for tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene is CC(C)(C)[NH-].C[Si](C)=[Ti+2].Cc1c[c-](C)c(C)c1C.
What is the InChIKey of tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene?
The InChIKey is SROHZWKMQFRMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13.C4H10N.C2H6Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;/h5H,1-4H3;5H,1-3H3;1-2H3;/q2*-1;;+2.
What are the key properties of tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene?
tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene has a molecular weight of 299.36 g/mol, XLogP of 5.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylazanide;dimethylsilylidenetitanium(2+);1,2,3,5-tetramethylcyclopenta-1,3-diene is sourced from PubChem (CID 151391574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).