N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride

C8H19ClNTi- — CID 174277868

IUPACN-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride
SMILESC[CH-]N(C(C)C)C(C)C.Cl.[Ti]
InChIInChI=1S/C8H18N.ClH.Ti/c1-6-9(7(2)3)8(4)5;;/h6-8H,1-5H3;1H;/q-1;;
InChIKeyBZIUQQSNASABJA-UHFFFAOYSA-N
MW212.57 g/mol
LogP2.71
Rot. Bonds3

About N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride

N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride (PubChem CID 174277868) has the molecular formula C8H19ClNTi- and a molecular weight of 212.57 g/mol. Its IUPAC name is N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride
PubChem CID174277868
Molecular FormulaC8H19ClNTi-
Molecular Weight212.57 g/mol
Exact Mass212.07
IUPAC NameN-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride
SMILESC[CH-]N(C(C)C)C(C)C.Cl.[Ti]
InChIInChI=1S/C8H18N.ClH.Ti/c1-6-9(7(2)3)8(4)5;;/h6-8H,1-5H3;1H;/q-1;;
InChIKeyBZIUQQSNASABJA-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.57
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

lithium;N-ethyl-N-propan-2-ylpropan-2-amine;hexane
CID 174508922
N,N-di(ethyl)propan-2-amine;yttrium
CID 158140365
N-methyl-N-[(2-methylhydrazinyl)methyl]propan-2-amine
CID 148735470
3-bromo-N-methyl-N-propan-2-ylpropan-1-amine
CID 61287527
N-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]thiohydroxylamine
CID 167101459
N'-methyl-N'-propan-2-ylbutane-1,4-diamine
CID 16748474
N-methyl-N-propan-2-yltridecan-1-amine
CID 88970420
N-methyl-4-[4-[methyl(propan-2-yl)amino]butoxy]-N-propan-2-ylbutan-1-amine
CID 59059943
(2S)-1-[methyl(propan-2-yl)amino]propan-2-ol
CID 93346500
ethene;N-ethyl-N-methylpropan-2-amine
CID 144977253
bis(2-methylpropane);dihydrochloride
CID 174914375
3-bromo-N,2,2-trimethyl-N-propan-2-ylpropan-1-amine
CID 65000340

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride?
The IUPAC name of N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride (CID 174277868) is N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride.
What is the SMILES notation for N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride?
The canonical SMILES for N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride is C[CH-]N(C(C)C)C(C)C.Cl.[Ti].
What is the InChIKey of N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride?
The InChIKey is BZIUQQSNASABJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N.ClH.Ti/c1-6-9(7(2)3)8(4)5;;/h6-8H,1-5H3;1H;/q-1;;.
What are the key properties of N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride?
N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride has a molecular weight of 212.57 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-ylpropan-2-amine;titanium;hydrochloride is sourced from PubChem (CID 174277868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).