2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone

C15H28N2O3 — CID 62014674

IUPAC2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CN(CCO)C2CCCC2)CC(C)O1
InChIInChI=1S/C15H28N2O3/c1-12-9-17(10-13(2)20-12)15(19)11-16(7-8-18)14-5-3-4-6-14/h12-14,18H,3-11H2,1-2H3
InChIKeyHRWKLJHTAUVVEJ-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.86
Rot. Bonds5

About 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone

2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 62014674) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID62014674
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CN(CCO)C2CCCC2)CC(C)O1
InChIInChI=1S/C15H28N2O3/c1-12-9-17(10-13(2)20-12)15(19)11-16(7-8-18)14-5-3-4-6-14/h12-14,18H,3-11H2,1-2H3
InChIKeyHRWKLJHTAUVVEJ-UHFFFAOYSA-N
XLogP0.86
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 62014674) is 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)CN(CCO)C2CCCC2)CC(C)O1.
What is the InChIKey of 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is HRWKLJHTAUVVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-12-9-17(10-13(2)20-12)15(19)11-16(7-8-18)14-5-3-4-6-14/h12-14,18H,3-11H2,1-2H3.
What are the key properties of 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone?
2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 284.40 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 62014674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).