1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine

C17H36N2O — CID 79666534

IUPAC1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine
SMILESCCCCCCCCCC(NC)C1CN(CC)CCO1
InChIInChI=1S/C17H36N2O/c1-4-6-7-8-9-10-11-12-16(18-3)17-15-19(5-2)13-14-20-17/h16-18H,4-15H2,1-3H3
InChIKeyUGPAOYHJHXCLNI-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.44
Rot. Bonds11

About 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine

1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine (PubChem CID 79666534) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine.

Molecular Properties

Compound Name1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine
PubChem CID79666534
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine
SMILESCCCCCCCCCC(NC)C1CN(CC)CCO1
InChIInChI=1S/C17H36N2O/c1-4-6-7-8-9-10-11-12-16(18-3)17-15-19(5-2)13-14-20-17/h16-18H,4-15H2,1-3H3
InChIKeyUGPAOYHJHXCLNI-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.44
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 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine?
The IUPAC name of 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine (CID 79666534) is 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine.
What is the SMILES notation for 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine?
The canonical SMILES for 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine is CCCCCCCCCC(NC)C1CN(CC)CCO1.
What is the InChIKey of 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine?
The InChIKey is UGPAOYHJHXCLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-4-6-7-8-9-10-11-12-16(18-3)17-15-19(5-2)13-14-20-17/h16-18H,4-15H2,1-3H3.
What are the key properties of 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine?
1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine has a molecular weight of 284.49 g/mol, XLogP of 3.44, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylmorpholin-2-yl)-N-methyldecan-1-amine is sourced from PubChem (CID 79666534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).