3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one

C11H16N2O2 — CID 118139919

IUPAC3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one
SMILESNc1cccn(C2CCC(O)CC2)c1=O
InChIInChI=1S/C11H16N2O2/c12-10-2-1-7-13(11(10)15)8-3-5-9(14)6-4-8/h1-2,7-9,14H,3-6,12H2
InChIKeyXUJNRCKPTXCESZ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.91
Rot. Bonds1

About 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one

3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one (PubChem CID 118139919) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one
PubChem CID118139919
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one
SMILESNc1cccn(C2CCC(O)CC2)c1=O
InChIInChI=1S/C11H16N2O2/c12-10-2-1-7-13(11(10)15)8-3-5-9(14)6-4-8/h1-2,7-9,14H,3-6,12H2
InChIKeyXUJNRCKPTXCESZ-UHFFFAOYSA-N
XLogP0.91
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one?
The IUPAC name of 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one (CID 118139919) is 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one is Nc1cccn(C2CCC(O)CC2)c1=O.
What is the InChIKey of 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one?
The InChIKey is XUJNRCKPTXCESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c12-10-2-1-7-13(11(10)15)8-3-5-9(14)6-4-8/h1-2,7-9,14H,3-6,12H2.
What are the key properties of 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one?
3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one has a molecular weight of 208.26 g/mol, XLogP of 0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(4-hydroxycyclohexyl)pyridin-2-one is sourced from PubChem (CID 118139919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).