potassium 2-[methanidyl(2-methylpropyl)amino]ethanol

C7H16KNO — CID 154651163

IUPACpotassium 2-[methanidyl(2-methylpropyl)amino]ethanol
SMILES[CH2-]N(CCO)CC(C)C.[K+]
InChIInChI=1S/C7H16NO.K/c1-7(2)6-8(3)4-5-9;/h7,9H,3-6H2,1-2H3;/q-1;+1
InChIKeyNYVTZHYJYUZMQO-UHFFFAOYSA-N
MW169.31 g/mol
LogP-2.27
Rot. Bonds4

About potassium 2-[methanidyl(2-methylpropyl)amino]ethanol

potassium 2-[methanidyl(2-methylpropyl)amino]ethanol (PubChem CID 154651163) has the molecular formula C7H16KNO and a molecular weight of 169.31 g/mol. Its IUPAC name is potassium 2-[methanidyl(2-methylpropyl)amino]ethanol.

Molecular Properties

Compound Namepotassium 2-[methanidyl(2-methylpropyl)amino]ethanol
PubChem CID154651163
Molecular FormulaC7H16KNO
Molecular Weight169.31 g/mol
Exact Mass169.09
IUPAC Namepotassium 2-[methanidyl(2-methylpropyl)amino]ethanol
SMILES[CH2-]N(CCO)CC(C)C.[K+]
InChIInChI=1S/C7H16NO.K/c1-7(2)6-8(3)4-5-9;/h7,9H,3-6H2,1-2H3;/q-1;+1
InChIKeyNYVTZHYJYUZMQO-UHFFFAOYSA-N
XLogP-2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 5-2.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-hydroxyethyl(methanidyl)amino]ethanol
CID 23545685
2-[methanidyl(propan-2-yl)amino]ethanol
CID 59626620
2-hydroxyethyl(2-methylpropyl)carbamic acid
CID 174562552
2-[methanidyl(propyl)amino]ethanol
CID 159970489
ethane;N-(2-hydroxyethyl)-N-(2-methylpropyl)acetamide
CID 177048994
(2S)-1-[2-hydroxyethyl-[(2R)-2-hydroxypropyl]amino]propan-2-ol
CID 6950665
4-[ethyl(2-methylpropyl)amino]butan-1-ol
CID 43509665
2-[2-[2-[bis(2-hydroxyethyl)amino]ethyl-(11-methyldodecyl)amino]ethyl-(2-hydroxyethyl)amino]ethanol
CID 11510944
2-[di(propan-2-yl)amino]ethanol;methane
CID 145105271
calcium;hydride;3-methylbutan-1-ol
CID 174734037
N,N,N',N'-tetrakis(2-methylpropyl)ethane-1,2-diamine
CID 18709992
sodium;hydride;3-methylbutan-1-ol
CID 173128134

Frequently Asked Questions

What is the IUPAC name of potassium 2-[methanidyl(2-methylpropyl)amino]ethanol?
The IUPAC name of potassium 2-[methanidyl(2-methylpropyl)amino]ethanol (CID 154651163) is potassium 2-[methanidyl(2-methylpropyl)amino]ethanol.
What is the SMILES notation for potassium 2-[methanidyl(2-methylpropyl)amino]ethanol?
The canonical SMILES for potassium 2-[methanidyl(2-methylpropyl)amino]ethanol is [CH2-]N(CCO)CC(C)C.[K+].
What is the InChIKey of potassium 2-[methanidyl(2-methylpropyl)amino]ethanol?
The InChIKey is NYVTZHYJYUZMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16NO.K/c1-7(2)6-8(3)4-5-9;/h7,9H,3-6H2,1-2H3;/q-1;+1.
What are the key properties of potassium 2-[methanidyl(2-methylpropyl)amino]ethanol?
potassium 2-[methanidyl(2-methylpropyl)amino]ethanol has a molecular weight of 169.31 g/mol, XLogP of -2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-[methanidyl(2-methylpropyl)amino]ethanol is sourced from PubChem (CID 154651163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).