1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one

C11H21NO2 — CID 62036480

IUPAC1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one
SMILESCC(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C11H21NO2/c1-10(14)9-12(7-8-13)11-5-3-2-4-6-11/h11,13H,2-9H2,1H3
InChIKeyHYNQMHNWHCHNJH-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.20
Rot. Bonds5

About 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one

1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one (PubChem CID 62036480) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one.

Molecular Properties

Compound Name1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one
PubChem CID62036480
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one
SMILESCC(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C11H21NO2/c1-10(14)9-12(7-8-13)11-5-3-2-4-6-11/h11,13H,2-9H2,1H3
InChIKeyHYNQMHNWHCHNJH-UHFFFAOYSA-N
XLogP1.20
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one?
The IUPAC name of 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one (CID 62036480) is 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one.
What is the SMILES notation for 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one?
The canonical SMILES for 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one is CC(=O)CN(CCO)C1CCCCC1.
What is the InChIKey of 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one?
The InChIKey is HYNQMHNWHCHNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-10(14)9-12(7-8-13)11-5-3-2-4-6-11/h11,13H,2-9H2,1H3.
What are the key properties of 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one?
1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one has a molecular weight of 199.29 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclohexyl(2-hydroxyethyl)amino]propan-2-one is sourced from PubChem (CID 62036480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).