2-[methyl(3-methylbutan-2-yl)amino]ethanol

C8H19NO — CID 43570451

IUPAC2-[methyl(3-methylbutan-2-yl)amino]ethanol
SMILESCC(C)C(C)N(C)CCO
InChIInChI=1S/C8H19NO/c1-7(2)8(3)9(4)5-6-10/h7-8,10H,5-6H2,1-4H3
InChIKeyDSRFARMQCOOOSK-UHFFFAOYSA-N
MW145.25 g/mol
LogP0.95
Rot. Bonds4

About 2-[methyl(3-methylbutan-2-yl)amino]ethanol

2-[methyl(3-methylbutan-2-yl)amino]ethanol (PubChem CID 43570451) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-[methyl(3-methylbutan-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl(3-methylbutan-2-yl)amino]ethanol
PubChem CID43570451
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-[methyl(3-methylbutan-2-yl)amino]ethanol
SMILESCC(C)C(C)N(C)CCO
InChIInChI=1S/C8H19NO/c1-7(2)8(3)9(4)5-6-10/h7-8,10H,5-6H2,1-4H3
InChIKeyDSRFARMQCOOOSK-UHFFFAOYSA-N
XLogP0.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(3-methylbutan-2-yl)amino]ethanol?
The IUPAC name of 2-[methyl(3-methylbutan-2-yl)amino]ethanol (CID 43570451) is 2-[methyl(3-methylbutan-2-yl)amino]ethanol.
What is the SMILES notation for 2-[methyl(3-methylbutan-2-yl)amino]ethanol?
The canonical SMILES for 2-[methyl(3-methylbutan-2-yl)amino]ethanol is CC(C)C(C)N(C)CCO.
What is the InChIKey of 2-[methyl(3-methylbutan-2-yl)amino]ethanol?
The InChIKey is DSRFARMQCOOOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(2)8(3)9(4)5-6-10/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 2-[methyl(3-methylbutan-2-yl)amino]ethanol?
2-[methyl(3-methylbutan-2-yl)amino]ethanol has a molecular weight of 145.25 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(3-methylbutan-2-yl)amino]ethanol is sourced from PubChem (CID 43570451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).