2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine

C14H30N2O — CID 83054455

IUPAC2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
SMILESCCCC(CNC(C)C)N1CCOC(CC)C1
InChIInChI=1S/C14H30N2O/c1-5-7-13(10-15-12(3)4)16-8-9-17-14(6-2)11-16/h12-15H,5-11H2,1-4H3
InChIKeyIPRDXKOLBODHHD-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.26
Rot. Bonds7

About 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine

2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine (PubChem CID 83054455) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
PubChem CID83054455
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
SMILESCCCC(CNC(C)C)N1CCOC(CC)C1
InChIInChI=1S/C14H30N2O/c1-5-7-13(10-15-12(3)4)16-8-9-17-14(6-2)11-16/h12-15H,5-11H2,1-4H3
InChIKeyIPRDXKOLBODHHD-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine (CID 83054455) is 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine is CCCC(CNC(C)C)N1CCOC(CC)C1.
What is the InChIKey of 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The InChIKey is IPRDXKOLBODHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-7-13(10-15-12(3)4)16-8-9-17-14(6-2)11-16/h12-15H,5-11H2,1-4H3.
What are the key properties of 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 83054455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).