pyridine;titanium

C5H5NTi — CID 87570870

IUPACpyridine;titanium
SMILES[Ti].c1ccncc1
InChIInChI=1S/C5H5N.Ti/c1-2-4-6-5-3-1;/h1-5H;
InChIKeyUAUWQDYZTPSTBL-UHFFFAOYSA-N
MW126.97 g/mol
LogP1.08
Rot. Bonds

About pyridine;titanium

pyridine;titanium (PubChem CID 87570870) has the molecular formula C5H5NTi and a molecular weight of 126.97 g/mol. Its IUPAC name is pyridine;titanium.

Molecular Properties

Compound Namepyridine;titanium
PubChem CID87570870
Molecular FormulaC5H5NTi
Molecular Weight126.97 g/mol
Exact Mass126.99
IUPAC Namepyridine;titanium
SMILES[Ti].c1ccncc1
InChIInChI=1S/C5H5N.Ti/c1-2-4-6-5-3-1;/h1-5H;
InChIKeyUAUWQDYZTPSTBL-UHFFFAOYSA-N
XLogP1.08
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.97
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,5-diazecine
CID 53440348
pyridine
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pyridine
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cobalt(2+);bis(pyridine)
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cadmium(2+);pyridine;chloride
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pyrazine;bis(pyridine)
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iridium(3+);tris(pyridine)
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chromium;bis(pyridine)
CID 14201778
bis(pyridine);hydrochloride
CID 68793121
CID 70045472
CID 70045472
pyridine bromide
CID 19422742
bis(pyridine);trihydroiodide
CID 175714675

Frequently Asked Questions

What is the IUPAC name of pyridine;titanium?
The IUPAC name of pyridine;titanium (CID 87570870) is pyridine;titanium.
What is the SMILES notation for pyridine;titanium?
The canonical SMILES for pyridine;titanium is [Ti].c1ccncc1.
What is the InChIKey of pyridine;titanium?
The InChIKey is UAUWQDYZTPSTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.Ti/c1-2-4-6-5-3-1;/h1-5H;.
What are the key properties of pyridine;titanium?
pyridine;titanium has a molecular weight of 126.97 g/mol, XLogP of 1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;titanium is sourced from PubChem (CID 87570870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).