2-[butyl(2-hydroxyethyl)amino]ethanol;titanium

C8H19NO2Ti — CID 174575595

IUPAC2-[butyl(2-hydroxyethyl)amino]ethanol;titanium
SMILESCCCCN(CCO)CCO.[Ti]
InChIInChI=1S/C8H19NO2.Ti/c1-2-3-4-9(5-7-10)6-8-11;/h10-11H,2-8H2,1H3;
InChIKeyOWBYHFOYXPZONR-UHFFFAOYSA-N
MW209.11 g/mol
LogP0.07
Rot. Bonds7

About 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium

2-[butyl(2-hydroxyethyl)amino]ethanol;titanium (PubChem CID 174575595) has the molecular formula C8H19NO2Ti and a molecular weight of 209.11 g/mol. Its IUPAC name is 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium.

Molecular Properties

Compound Name2-[butyl(2-hydroxyethyl)amino]ethanol;titanium
PubChem CID174575595
Molecular FormulaC8H19NO2Ti
Molecular Weight209.11 g/mol
Exact Mass209.09
IUPAC Name2-[butyl(2-hydroxyethyl)amino]ethanol;titanium
SMILESCCCCN(CCO)CCO.[Ti]
InChIInChI=1S/C8H19NO2.Ti/c1-2-3-4-9(5-7-10)6-8-11;/h10-11H,2-8H2,1H3;
InChIKeyOWBYHFOYXPZONR-UHFFFAOYSA-N
XLogP0.07
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.11
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butyl(2-hydroxyethyl)amino]ethanol
CID 23103220
2-[butyl(2-hydroxyethyl)amino]ethanol;2-[2-hydroxyethyl(octadecyl)amino]ethanol
CID 161305073
2-[bis(2-hydroxyethyl)amino]ethanol;N,N-dipentylpentan-1-amine
CID 158613342
2-[2-hydroxyethyl(octacosyl)amino]ethanol
CID 18358549
2-[2-hydroxyethyl(icosyl)amino]ethanol
CID 14389687
2-[bis(2-hydroxyethyl)amino]ethanol;bis(butan-1-ol);titanium;dihydrate
CID 88801518
bis(2-[butyl(2-hydroxyethyl)amino]ethanol);sulfuric acid
CID 173031476
2-[2-hydroxyethyl(octadecyl)amino]ethanol;hydrochloride
CID 22999610
2-[butyl(2-hydroxyethyl)amino]ethanol;methanesulfonic acid
CID 131862284
3-[hexyl(2-hydroxyethyl)amino]propan-1-ol
CID 138077793
2-[octadecyl(propyl)amino]ethanol
CID 151447456
2-[hexadecyl(propyl)amino]ethanol
CID 18346925

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium?
The IUPAC name of 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium (CID 174575595) is 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium.
What is the SMILES notation for 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium?
The canonical SMILES for 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium is CCCCN(CCO)CCO.[Ti].
What is the InChIKey of 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium?
The InChIKey is OWBYHFOYXPZONR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2.Ti/c1-2-3-4-9(5-7-10)6-8-11;/h10-11H,2-8H2,1H3;.
What are the key properties of 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium?
2-[butyl(2-hydroxyethyl)amino]ethanol;titanium has a molecular weight of 209.11 g/mol, XLogP of 0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(2-hydroxyethyl)amino]ethanol;titanium is sourced from PubChem (CID 174575595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).