N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine

C8H19NO — CID 58160373

IUPACN,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCC(OC(C)(C)C)N(C)C
InChIInChI=1S/C8H19NO/c1-7(9(5)6)10-8(2,3)4/h7H,1-6H3
InChIKeyYESOARDUBHMNAT-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.71
Rot. Bonds2

About N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine

N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine (PubChem CID 58160373) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine
PubChem CID58160373
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCC(OC(C)(C)C)N(C)C
InChIInChI=1S/C8H19NO/c1-7(9(5)6)10-8(2,3)4/h7H,1-6H3
InChIKeyYESOARDUBHMNAT-UHFFFAOYSA-N
XLogP1.71
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine?
The IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine (CID 58160373) is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine.
What is the SMILES notation for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine?
The canonical SMILES for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine is CC(OC(C)(C)C)N(C)C.
What is the InChIKey of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine?
The InChIKey is YESOARDUBHMNAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(9(5)6)10-8(2,3)4/h7H,1-6H3.
What are the key properties of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine?
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine has a molecular weight of 145.25 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethanamine is sourced from PubChem (CID 58160373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).