N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine

C13H24N2O — CID 79668802

IUPACN-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine
SMILESCC#CCC(NCC)C1CN(CC)CCO1
InChIInChI=1S/C13H24N2O/c1-4-7-8-12(14-5-2)13-11-15(6-3)9-10-16-13/h12-14H,5-6,8-11H2,1-3H3
InChIKeyYHEMVKBKJPSMHT-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.10
Rot. Bonds5

About N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine

N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine (PubChem CID 79668802) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine
PubChem CID79668802
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine
SMILESCC#CCC(NCC)C1CN(CC)CCO1
InChIInChI=1S/C13H24N2O/c1-4-7-8-12(14-5-2)13-11-15(6-3)9-10-16-13/h12-14H,5-6,8-11H2,1-3H3
InChIKeyYHEMVKBKJPSMHT-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-1-(4-ethylmorpholin-2-yl)-4-methylpentan-1-amine
CID 79669723
N-ethyl-1-(4-ethylmorpholin-2-yl)-4,4-dimethylpentan-1-amine
CID 79669489
N-ethyl-1-(4-ethylmorpholin-2-yl)-3-methylsulfonylpropan-1-amine
CID 79669032
N-ethyl-1-(4-ethylmorpholin-2-yl)-2,2-dimethylpropan-1-amine
CID 79668725
N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 79669495
N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(4-fluorophenyl)ethanamine
CID 79668876
1-(4-ethylmorpholin-2-yl)propylhydrazine
CID 105247603
N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 79669575
N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050180
N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79824289
[1-(4-ethylmorpholin-2-yl)-3-methylpentyl]hydrazine
CID 105247659
1-(4-ethylmorpholin-2-yl)-N-propylprop-2-yn-1-amine
CID 79669262

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine?
The IUPAC name of N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine (CID 79668802) is N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine.
What is the SMILES notation for N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine?
The canonical SMILES for N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine is CC#CCC(NCC)C1CN(CC)CCO1.
What is the InChIKey of N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine?
The InChIKey is YHEMVKBKJPSMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-4-7-8-12(14-5-2)13-11-15(6-3)9-10-16-13/h12-14H,5-6,8-11H2,1-3H3.
What are the key properties of N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine?
N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine has a molecular weight of 224.35 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-ethylmorpholin-2-yl)pent-3-yn-1-amine is sourced from PubChem (CID 79668802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).