N-ethylethanamine;propan-2-ol;titanium

C7H18NOTi- — CID 59928872

IUPACN-ethylethanamine;propan-2-ol;titanium
SMILESCC(C)O.[CH2-]CNCC.[Ti]
InChIInChI=1S/C4H10N.C3H8O.Ti/c1-3-5-4-2;1-3(2)4;/h5H,1,3-4H2,2H3;3-4H,1-2H3;/q-1;;
InChIKeyYVAVIPBFMZCXRZ-UHFFFAOYSA-N
MW180.09 g/mol
LogP0.81
Rot. Bonds2

About N-ethylethanamine;propan-2-ol;titanium

N-ethylethanamine;propan-2-ol;titanium (PubChem CID 59928872) has the molecular formula C7H18NOTi- and a molecular weight of 180.09 g/mol. Its IUPAC name is N-ethylethanamine;propan-2-ol;titanium.

Molecular Properties

Compound NameN-ethylethanamine;propan-2-ol;titanium
PubChem CID59928872
Molecular FormulaC7H18NOTi-
Molecular Weight180.09 g/mol
Exact Mass180.09
IUPAC NameN-ethylethanamine;propan-2-ol;titanium
SMILESCC(C)O.[CH2-]CNCC.[Ti]
InChIInChI=1S/C4H10N.C3H8O.Ti/c1-3-5-4-2;1-3(2)4;/h5H,1,3-4H2,2H3;3-4H,1-2H3;/q-1;;
InChIKeyYVAVIPBFMZCXRZ-UHFFFAOYSA-N
XLogP0.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.09
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

propane;tris(propan-2-ol);titanium
CID 139888179
N-ethylethanamine;hexane;methanol;propan-2-ol
CID 86585335
N-ethylethanamine;tungsten(2+)
CID 22952926
propan-2-ol;titanium
CID 25200171
2-(ethylaminomethyl)butane-1,3-diol
CID 139939202
bis(2-methylpropan-1-ol);bis(propan-2-ol);titanium
CID 22628754
2-methanidylpropane;tris(propan-2-ol);titanium
CID 134890995
dodecane;propan-2-ol;titanium
CID 88687204
tetrakis(propan-1-ol);tetrakis(propan-2-ol);titanium
CID 87932046
tris(propan-2-ol);titanium;hydrate
CID 22645817
CID 175756453
CID 175756453
bis(propan-2-ol);titanium;hydrochloride
CID 87233898

Frequently Asked Questions

What is the IUPAC name of N-ethylethanamine;propan-2-ol;titanium?
The IUPAC name of N-ethylethanamine;propan-2-ol;titanium (CID 59928872) is N-ethylethanamine;propan-2-ol;titanium.
What is the SMILES notation for N-ethylethanamine;propan-2-ol;titanium?
The canonical SMILES for N-ethylethanamine;propan-2-ol;titanium is CC(C)O.[CH2-]CNCC.[Ti].
What is the InChIKey of N-ethylethanamine;propan-2-ol;titanium?
The InChIKey is YVAVIPBFMZCXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N.C3H8O.Ti/c1-3-5-4-2;1-3(2)4;/h5H,1,3-4H2,2H3;3-4H,1-2H3;/q-1;;.
What are the key properties of N-ethylethanamine;propan-2-ol;titanium?
N-ethylethanamine;propan-2-ol;titanium has a molecular weight of 180.09 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylethanamine;propan-2-ol;titanium is sourced from PubChem (CID 59928872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).