5-amino-1-cyclohexyl-6-methylpyridin-2-one

C12H18N2O — CID 165473593

IUPAC5-amino-1-cyclohexyl-6-methylpyridin-2-one
SMILESCc1c(N)ccc(=O)n1C1CCCCC1
InChIInChI=1S/C12H18N2O/c1-9-11(13)7-8-12(15)14(9)10-5-3-2-4-6-10/h7-8,10H,2-6,13H2,1H3
InChIKeyVXXZDVBPRIWNMT-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.24
Rot. Bonds1

About 5-amino-1-cyclohexyl-6-methylpyridin-2-one

5-amino-1-cyclohexyl-6-methylpyridin-2-one (PubChem CID 165473593) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-amino-1-cyclohexyl-6-methylpyridin-2-one.

Molecular Properties

Compound Name5-amino-1-cyclohexyl-6-methylpyridin-2-one
PubChem CID165473593
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name5-amino-1-cyclohexyl-6-methylpyridin-2-one
SMILESCc1c(N)ccc(=O)n1C1CCCCC1
InChIInChI=1S/C12H18N2O/c1-9-11(13)7-8-12(15)14(9)10-5-3-2-4-6-10/h7-8,10H,2-6,13H2,1H3
InChIKeyVXXZDVBPRIWNMT-UHFFFAOYSA-N
XLogP2.24
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-cyclohexyl-6-methylpyridin-2-one?
The IUPAC name of 5-amino-1-cyclohexyl-6-methylpyridin-2-one (CID 165473593) is 5-amino-1-cyclohexyl-6-methylpyridin-2-one.
What is the SMILES notation for 5-amino-1-cyclohexyl-6-methylpyridin-2-one?
The canonical SMILES for 5-amino-1-cyclohexyl-6-methylpyridin-2-one is Cc1c(N)ccc(=O)n1C1CCCCC1.
What is the InChIKey of 5-amino-1-cyclohexyl-6-methylpyridin-2-one?
The InChIKey is VXXZDVBPRIWNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-11(13)7-8-12(15)14(9)10-5-3-2-4-6-10/h7-8,10H,2-6,13H2,1H3.
What are the key properties of 5-amino-1-cyclohexyl-6-methylpyridin-2-one?
5-amino-1-cyclohexyl-6-methylpyridin-2-one has a molecular weight of 206.29 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-cyclohexyl-6-methylpyridin-2-one is sourced from PubChem (CID 165473593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).