2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol

C8H20N2O — CID 28759304

IUPAC2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol
SMILESCCN(CCO)C(C)(C)CN
InChIInChI=1S/C8H20N2O/c1-4-10(5-6-11)8(2,3)7-9/h11H,4-7,9H2,1-3H3
InChIKeyVYBHKLKUVAHDFQ-UHFFFAOYSA-N
MW160.26 g/mol
LogP0.04
Rot. Bonds5

About 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol

2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol (PubChem CID 28759304) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol.

Molecular Properties

Compound Name2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol
PubChem CID28759304
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol
SMILESCCN(CCO)C(C)(C)CN
InChIInChI=1S/C8H20N2O/c1-4-10(5-6-11)8(2,3)7-9/h11H,4-7,9H2,1-3H3
InChIKeyVYBHKLKUVAHDFQ-UHFFFAOYSA-N
XLogP0.04
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol?
The IUPAC name of 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol (CID 28759304) is 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol.
What is the SMILES notation for 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol?
The canonical SMILES for 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol is CCN(CCO)C(C)(C)CN.
What is the InChIKey of 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol?
The InChIKey is VYBHKLKUVAHDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O/c1-4-10(5-6-11)8(2,3)7-9/h11H,4-7,9H2,1-3H3.
What are the key properties of 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol?
2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol has a molecular weight of 160.26 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-amino-2-methylpropan-2-yl)-ethylamino]ethanol is sourced from PubChem (CID 28759304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).