6-cyclohexyl-4-methyl-1-propoxypyridin-2-one

C15H23NO2 — CID 163530033

IUPAC6-cyclohexyl-4-methyl-1-propoxypyridin-2-one
SMILESCCCOn1c(C2CCCCC2)cc(C)cc1=O
InChIInChI=1S/C15H23NO2/c1-3-9-18-16-14(10-12(2)11-15(16)17)13-7-5-4-6-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyDSEKFIKYEYOMDV-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.04
Rot. Bonds4

About 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one

6-cyclohexyl-4-methyl-1-propoxypyridin-2-one (PubChem CID 163530033) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one.

Molecular Properties

Compound Name6-cyclohexyl-4-methyl-1-propoxypyridin-2-one
PubChem CID163530033
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name6-cyclohexyl-4-methyl-1-propoxypyridin-2-one
SMILESCCCOn1c(C2CCCCC2)cc(C)cc1=O
InChIInChI=1S/C15H23NO2/c1-3-9-18-16-14(10-12(2)11-15(16)17)13-7-5-4-6-8-13/h10-11,13H,3-9H2,1-2H3
InChIKeyDSEKFIKYEYOMDV-UHFFFAOYSA-N
XLogP3.04
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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2-azanidylethanolate;6-cyclohexyl-4-methyl-1-oxidopyridin-2-one;iron(3+)
CID 78427510
bis(2-aminoethanol);cyclohexanol;tris(6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one)
CID 174864587
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CID 105496296
6-cyclohexyl-5-deuterio-4-(deuteriomethyl)-1-hydroxypyridin-2-one
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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one?
The IUPAC name of 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one (CID 163530033) is 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one.
What is the SMILES notation for 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one?
The canonical SMILES for 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one is CCCOn1c(C2CCCCC2)cc(C)cc1=O.
What is the InChIKey of 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one?
The InChIKey is DSEKFIKYEYOMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-9-18-16-14(10-12(2)11-15(16)17)13-7-5-4-6-8-13/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one?
6-cyclohexyl-4-methyl-1-propoxypyridin-2-one has a molecular weight of 249.35 g/mol, XLogP of 3.04, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-4-methyl-1-propoxypyridin-2-one is sourced from PubChem (CID 163530033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).