morpholin-4-ide;titanium

C4H8NOTi- — CID 151347751

IUPACmorpholin-4-ide;titanium
SMILESC1COCC[N-]1.[Ti]
InChIInChI=1S/C4H8NO.Ti/c1-3-6-4-2-5-1;/h1-4H2;/q-1;
InChIKeyWBSIWOFKHGHLLD-UHFFFAOYSA-N
MW133.98 g/mol
LogP0.39
Rot. Bonds

About morpholin-4-ide;titanium

morpholin-4-ide;titanium (PubChem CID 151347751) has the molecular formula C4H8NOTi- and a molecular weight of 133.98 g/mol. Its IUPAC name is morpholin-4-ide;titanium.

Molecular Properties

Compound Namemorpholin-4-ide;titanium
PubChem CID151347751
Molecular FormulaC4H8NOTi-
Molecular Weight133.98 g/mol
Exact Mass134.01
IUPAC Namemorpholin-4-ide;titanium
SMILESC1COCC[N-]1.[Ti]
InChIInChI=1S/C4H8NO.Ti/c1-3-6-4-2-5-1;/h1-4H2;/q-1;
InChIKeyWBSIWOFKHGHLLD-UHFFFAOYSA-N
XLogP0.39
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.98
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-ide;titanium?
The IUPAC name of morpholin-4-ide;titanium (CID 151347751) is morpholin-4-ide;titanium.
What is the SMILES notation for morpholin-4-ide;titanium?
The canonical SMILES for morpholin-4-ide;titanium is C1COCC[N-]1.[Ti].
What is the InChIKey of morpholin-4-ide;titanium?
The InChIKey is WBSIWOFKHGHLLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8NO.Ti/c1-3-6-4-2-5-1;/h1-4H2;/q-1;.
What are the key properties of morpholin-4-ide;titanium?
morpholin-4-ide;titanium has a molecular weight of 133.98 g/mol, XLogP of 0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-ide;titanium is sourced from PubChem (CID 151347751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).