bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)

C26H30N4O2Ti — CID 135489220

IUPACbis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)
SMILESC[N-]C.C[N-]C.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Ti+2]
InChIInChI=1S/2C11H9NO.2C2H6N.Ti/c2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;2*1-3-2;/h2*1-8,13H;2*1-2H3;/q;;2*-1;+2
InChIKeySDKOPIZUOCAVNS-UHFFFAOYSA-N
MW478.42 g/mol
LogP6.15
Rot. Bonds2

About bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)

bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+) (PubChem CID 135489220) has the molecular formula C26H30N4O2Ti and a molecular weight of 478.42 g/mol. Its IUPAC name is bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+).

Molecular Properties

Compound Namebis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)
PubChem CID135489220
Molecular FormulaC26H30N4O2Ti
Molecular Weight478.42 g/mol
Exact Mass478.18
IUPAC Namebis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)
SMILESC[N-]C.C[N-]C.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Ti+2]
InChIInChI=1S/2C11H9NO.2C2H6N.Ti/c2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;2*1-3-2;/h2*1-8,13H;2*1-2H3;/q;;2*-1;+2
InChIKeySDKOPIZUOCAVNS-UHFFFAOYSA-N
XLogP6.15
TPSA94.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.42
LogP ≤ 56.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyridin-2-ylphenol;hydrate
CID 175244966
2,6-bis(2-pyridin-2-ylphenyl)phenol
CID 175876654
2-(2-methylphenyl)pyridine
CID 144596153
CID 158478788
CID 158478788
[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid
CID 175560830
2-[2-[2-(2-pyridin-2-ylphenyl)ethenyl]phenyl]pyridine
CID 154584408
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
CID 58803467
CID 58803467
2-(2-propan-2-ylphenyl)pyridine
CID 55253137
2-(2-tert-butylphenyl)pyridine
CID 67807360
2-(2-methylselanylphenyl)pyridine
CID 139264776
cobalt;ethane;tris(2-pyridin-2-ylpyridine)
CID 161013986

Frequently Asked Questions

What is the IUPAC name of bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)?
The IUPAC name of bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+) (CID 135489220) is bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+).
What is the SMILES notation for bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)?
The canonical SMILES for bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+) is C[N-]C.C[N-]C.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Ti+2].
What is the InChIKey of bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)?
The InChIKey is SDKOPIZUOCAVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H9NO.2C2H6N.Ti/c2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;2*1-3-2;/h2*1-8,13H;2*1-2H3;/q;;2*-1;+2.
What are the key properties of bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)?
bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+) has a molecular weight of 478.42 g/mol, XLogP of 6.15, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+) is sourced from PubChem (CID 135489220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).