2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one

C15H26N2O2 — CID 60638690

IUPAC2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCCC1=CCCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H26N2O2/c1-13(15(18)17-9-11-19-12-10-17)16-8-7-14-5-3-2-4-6-14/h5,13,16H,2-4,6-12H2,1H3
InChIKeyYFCGSDHTLYYITQ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.71
Rot. Bonds5

About 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one

2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one (PubChem CID 60638690) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one
PubChem CID60638690
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCCC1=CCCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H26N2O2/c1-13(15(18)17-9-11-19-12-10-17)16-8-7-14-5-3-2-4-6-14/h5,13,16H,2-4,6-12H2,1H3
InChIKeyYFCGSDHTLYYITQ-UHFFFAOYSA-N
XLogP1.71
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one (CID 60638690) is 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one is CC(NCCC1=CCCCC1)C(=O)N1CCOCC1.
What is the InChIKey of 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is YFCGSDHTLYYITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-13(15(18)17-9-11-19-12-10-17)16-8-7-14-5-3-2-4-6-14/h5,13,16H,2-4,6-12H2,1H3.
What are the key properties of 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one?
2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 266.38 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclohexen-1-yl)ethylamino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 60638690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).