2-(3-Methylpentan-3-yloxy)ethanamine

C8H19NO — CID 87222058

IUPAC2-(3-methylpentan-3-yloxy)ethanamine
SMILESCCC(C)(CC)OCCN
InChIInChI=1S/C8H19NO/c1-4-8(3,5-2)10-7-6-9/h4-7,9H2,1-3H3
InChIKeyXNTOUENMSNIOBD-UHFFFAOYSA-N
MW145.24 g/mol
LogP1.20
Rot. Bonds5

About 2-(3-Methylpentan-3-yloxy)ethanamine

2-(3-Methylpentan-3-yloxy)ethanamine (PubChem CID 87222058) has the molecular formula C8H19NO and a molecular weight of 145.24 g/mol. Its IUPAC name is 2-(3-methylpentan-3-yloxy)ethanamine.

Molecular Properties

Compound Name2-(3-Methylpentan-3-yloxy)ethanamine
PubChem CID87222058
Molecular FormulaC8H19NO
Molecular Weight145.24 g/mol
Exact Mass145.15
IUPAC Name2-(3-methylpentan-3-yloxy)ethanamine
SMILESCCC(C)(CC)OCCN
InChIInChI=1S/C8H19NO/c1-4-8(3,5-2)10-7-6-9/h4-7,9H2,1-3H3
InChIKeyXNTOUENMSNIOBD-UHFFFAOYSA-N
XLogP1.20
TPSA35.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity79

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.24
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-Methylpentan-3-yloxy)ethanamine?
The IUPAC name of 2-(3-Methylpentan-3-yloxy)ethanamine (CID 87222058) is 2-(3-methylpentan-3-yloxy)ethanamine.
What is the SMILES notation for 2-(3-Methylpentan-3-yloxy)ethanamine?
The canonical SMILES for 2-(3-Methylpentan-3-yloxy)ethanamine is CCC(C)(CC)OCCN.
What is the InChIKey of 2-(3-Methylpentan-3-yloxy)ethanamine?
The InChIKey is XNTOUENMSNIOBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-4-8(3,5-2)10-7-6-9/h4-7,9H2,1-3H3.
What are the key properties of 2-(3-Methylpentan-3-yloxy)ethanamine?
2-(3-Methylpentan-3-yloxy)ethanamine has a molecular weight of 145.24 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-Methylpentan-3-yloxy)ethanamine is sourced from PubChem (CID 87222058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).