4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine

C10H23NO2 — CID 43146963

IUPAC4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine
SMILESCOCCNC(C)CC(C)(C)OC
InChIInChI=1S/C10H23NO2/c1-9(11-6-7-12-4)8-10(2,3)13-5/h9,11H,6-8H2,1-5H3
InChIKeySSSRGPWAOARHQD-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.43
Rot. Bonds7

About 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine

4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine (PubChem CID 43146963) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine.

Molecular Properties

Compound Name4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine
PubChem CID43146963
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine
SMILESCOCCNC(C)CC(C)(C)OC
InChIInChI=1S/C10H23NO2/c1-9(11-6-7-12-4)8-10(2,3)13-5/h9,11H,6-8H2,1-5H3
InChIKeySSSRGPWAOARHQD-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine?
The IUPAC name of 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine (CID 43146963) is 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine.
What is the SMILES notation for 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine?
The canonical SMILES for 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine is COCCNC(C)CC(C)(C)OC.
What is the InChIKey of 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine?
The InChIKey is SSSRGPWAOARHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-9(11-6-7-12-4)8-10(2,3)13-5/h9,11H,6-8H2,1-5H3.
What are the key properties of 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine?
4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methoxyethyl)-4-methylpentan-2-amine is sourced from PubChem (CID 43146963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).