N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine

C12H24N2O — CID 79669495

IUPACN-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine
SMILESCCNC(C1CC1)C1CN(CC)CCO1
InChIInChI=1S/C12H24N2O/c1-3-13-12(10-5-6-10)11-9-14(4-2)7-8-15-11/h10-13H,3-9H2,1-2H3
InChIKeyIREHQSKGXYOERB-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds5

About N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine

N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine (PubChem CID 79669495) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine
PubChem CID79669495
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine
SMILESCCNC(C1CC1)C1CN(CC)CCO1
InChIInChI=1S/C12H24N2O/c1-3-13-12(10-5-6-10)11-9-14(4-2)7-8-15-11/h10-13H,3-9H2,1-2H3
InChIKeyIREHQSKGXYOERB-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine?
The IUPAC name of N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine (CID 79669495) is N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine?
The canonical SMILES for N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine is CCNC(C1CC1)C1CN(CC)CCO1.
What is the InChIKey of N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine?
The InChIKey is IREHQSKGXYOERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-13-12(10-5-6-10)11-9-14(4-2)7-8-15-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine?
N-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine has a molecular weight of 212.34 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-[cyclopropyl-(4-ethylmorpholin-2-yl)methyl]ethanamine is sourced from PubChem (CID 79669495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).