1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one

C15H24N2O2 — CID 78954452

IUPAC1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one
SMILESO=c1ccccn1CCN(CCO)C1CCCCC1
InChIInChI=1S/C15H24N2O2/c18-13-12-16(14-6-2-1-3-7-14)10-11-17-9-5-4-8-15(17)19/h4-5,8-9,14,18H,1-3,6-7,10-13H2
InChIKeyLTWIDDKEKNWUOP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.48
Rot. Bonds6

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

1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one (PubChem CID 78954452) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one
PubChem CID78954452
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one
SMILESO=c1ccccn1CCN(CCO)C1CCCCC1
InChIInChI=1S/C15H24N2O2/c18-13-12-16(14-6-2-1-3-7-14)10-11-17-9-5-4-8-15(17)19/h4-5,8-9,14,18H,1-3,6-7,10-13H2
InChIKeyLTWIDDKEKNWUOP-UHFFFAOYSA-N
XLogP1.48
TPSA45.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one?
The IUPAC name of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one (CID 78954452) is 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one is O=c1ccccn1CCN(CCO)C1CCCCC1.
What is the InChIKey of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one?
The InChIKey is LTWIDDKEKNWUOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c18-13-12-16(14-6-2-1-3-7-14)10-11-17-9-5-4-8-15(17)19/h4-5,8-9,14,18H,1-3,6-7,10-13H2.
What are the key properties of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one?
1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one has a molecular weight of 264.37 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]ethyl]pyridin-2-one is sourced from PubChem (CID 78954452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).