4-methoxy-2,4-dimethylpentan-2-amine

C8H19NO — CID 131162417

IUPAC4-methoxy-2,4-dimethylpentan-2-amine
SMILESCOC(C)(C)CC(C)(C)N
InChIInChI=1S/C8H19NO/c1-7(2,9)6-8(3,4)10-5/h6,9H2,1-5H3
InChIKeyAFZJPAIXPOBYMI-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.54
Rot. Bonds3

About 4-methoxy-2,4-dimethylpentan-2-amine

4-methoxy-2,4-dimethylpentan-2-amine (PubChem CID 131162417) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 4-methoxy-2,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name4-methoxy-2,4-dimethylpentan-2-amine
PubChem CID131162417
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name4-methoxy-2,4-dimethylpentan-2-amine
SMILESCOC(C)(C)CC(C)(C)N
InChIInChI=1S/C8H19NO/c1-7(2,9)6-8(3,4)10-5/h6,9H2,1-5H3
InChIKeyAFZJPAIXPOBYMI-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,4-dimethylpentan-2-amine?
The IUPAC name of 4-methoxy-2,4-dimethylpentan-2-amine (CID 131162417) is 4-methoxy-2,4-dimethylpentan-2-amine.
What is the SMILES notation for 4-methoxy-2,4-dimethylpentan-2-amine?
The canonical SMILES for 4-methoxy-2,4-dimethylpentan-2-amine is COC(C)(C)CC(C)(C)N.
What is the InChIKey of 4-methoxy-2,4-dimethylpentan-2-amine?
The InChIKey is AFZJPAIXPOBYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(2,9)6-8(3,4)10-5/h6,9H2,1-5H3.
What are the key properties of 4-methoxy-2,4-dimethylpentan-2-amine?
4-methoxy-2,4-dimethylpentan-2-amine has a molecular weight of 145.25 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,4-dimethylpentan-2-amine is sourced from PubChem (CID 131162417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).