2-methoxy-N-(2-methoxybutyl)butan-1-amine

C10H23NO2 — CID 87913992

IUPAC2-methoxy-N-(2-methoxybutyl)butan-1-amine
SMILESCCC(CNCC(CC)OC)OC
InChIInChI=1S/C10H23NO2/c1-5-9(12-3)7-11-8-10(6-2)13-4/h9-11H,5-8H2,1-4H3
InChIKeyZHOZYUSMZFLBCU-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.43
Rot. Bonds8

About 2-methoxy-N-(2-methoxybutyl)butan-1-amine

2-methoxy-N-(2-methoxybutyl)butan-1-amine (PubChem CID 87913992) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-methoxy-N-(2-methoxybutyl)butan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-(2-methoxybutyl)butan-1-amine
PubChem CID87913992
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name2-methoxy-N-(2-methoxybutyl)butan-1-amine
SMILESCCC(CNCC(CC)OC)OC
InChIInChI=1S/C10H23NO2/c1-5-9(12-3)7-11-8-10(6-2)13-4/h9-11H,5-8H2,1-4H3
InChIKeyZHOZYUSMZFLBCU-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-methoxybutyl)butan-1-amine?
The IUPAC name of 2-methoxy-N-(2-methoxybutyl)butan-1-amine (CID 87913992) is 2-methoxy-N-(2-methoxybutyl)butan-1-amine.
What is the SMILES notation for 2-methoxy-N-(2-methoxybutyl)butan-1-amine?
The canonical SMILES for 2-methoxy-N-(2-methoxybutyl)butan-1-amine is CCC(CNCC(CC)OC)OC.
What is the InChIKey of 2-methoxy-N-(2-methoxybutyl)butan-1-amine?
The InChIKey is ZHOZYUSMZFLBCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-5-9(12-3)7-11-8-10(6-2)13-4/h9-11H,5-8H2,1-4H3.
What are the key properties of 2-methoxy-N-(2-methoxybutyl)butan-1-amine?
2-methoxy-N-(2-methoxybutyl)butan-1-amine has a molecular weight of 189.30 g/mol, XLogP of 1.43, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methoxybutyl)butan-1-amine is sourced from PubChem (CID 87913992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).