2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone

C13H24N2O2 — CID 54928560

IUPAC2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone
SMILESCCC1COCCN1C(=O)CNC1CCCC1
InChIInChI=1S/C13H24N2O2/c1-2-12-10-17-8-7-15(12)13(16)9-14-11-5-3-4-6-11/h11-12,14H,2-10H2,1H3
InChIKeyLPEBOHMHRBQZTB-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.16
Rot. Bonds4

About 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone

2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone (PubChem CID 54928560) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone
PubChem CID54928560
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone
SMILESCCC1COCCN1C(=O)CNC1CCCC1
InChIInChI=1S/C13H24N2O2/c1-2-12-10-17-8-7-15(12)13(16)9-14-11-5-3-4-6-11/h11-12,14H,2-10H2,1H3
InChIKeyLPEBOHMHRBQZTB-UHFFFAOYSA-N
XLogP1.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone (CID 54928560) is 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone is CCC1COCCN1C(=O)CNC1CCCC1.
What is the InChIKey of 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone?
The InChIKey is LPEBOHMHRBQZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-12-10-17-8-7-15(12)13(16)9-14-11-5-3-4-6-11/h11-12,14H,2-10H2,1H3.
What are the key properties of 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone?
2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone has a molecular weight of 240.35 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-1-(3-ethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 54928560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).