2-(methoxymethyl)-N,N-dimethylbutan-1-amine

C8H19NO — CID 118122887

IUPAC2-(methoxymethyl)-N,N-dimethylbutan-1-amine
SMILESCCC(COC)CN(C)C
InChIInChI=1S/C8H19NO/c1-5-8(7-10-4)6-9(2)3/h8H,5-7H2,1-4H3
InChIKeyNPQWHAAVPLBDLR-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.22
Rot. Bonds5

About 2-(methoxymethyl)-N,N-dimethylbutan-1-amine

2-(methoxymethyl)-N,N-dimethylbutan-1-amine (PubChem CID 118122887) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-(methoxymethyl)-N,N-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N,N-dimethylbutan-1-amine
PubChem CID118122887
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-(methoxymethyl)-N,N-dimethylbutan-1-amine
SMILESCCC(COC)CN(C)C
InChIInChI=1S/C8H19NO/c1-5-8(7-10-4)6-9(2)3/h8H,5-7H2,1-4H3
InChIKeyNPQWHAAVPLBDLR-UHFFFAOYSA-N
XLogP1.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N,N-dimethylbutan-1-amine?
The IUPAC name of 2-(methoxymethyl)-N,N-dimethylbutan-1-amine (CID 118122887) is 2-(methoxymethyl)-N,N-dimethylbutan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N,N-dimethylbutan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N,N-dimethylbutan-1-amine is CCC(COC)CN(C)C.
What is the InChIKey of 2-(methoxymethyl)-N,N-dimethylbutan-1-amine?
The InChIKey is NPQWHAAVPLBDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-5-8(7-10-4)6-9(2)3/h8H,5-7H2,1-4H3.
What are the key properties of 2-(methoxymethyl)-N,N-dimethylbutan-1-amine?
2-(methoxymethyl)-N,N-dimethylbutan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 1.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N,N-dimethylbutan-1-amine is sourced from PubChem (CID 118122887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).