5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one

C10H16N2O2 — CID 130571796

IUPAC5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one
SMILESCc1c(N)ccc(=O)n1COC(C)C
InChIInChI=1S/C10H16N2O2/c1-7(2)14-6-12-8(3)9(11)4-5-10(12)13/h4-5,7H,6,11H2,1-3H3
InChIKeyZOOOYPWOSSYULL-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.12
Rot. Bonds3

About 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one

5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one (PubChem CID 130571796) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one.

Molecular Properties

Compound Name5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one
PubChem CID130571796
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one
SMILESCc1c(N)ccc(=O)n1COC(C)C
InChIInChI=1S/C10H16N2O2/c1-7(2)14-6-12-8(3)9(11)4-5-10(12)13/h4-5,7H,6,11H2,1-3H3
InChIKeyZOOOYPWOSSYULL-UHFFFAOYSA-N
XLogP1.12
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one?
The IUPAC name of 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one (CID 130571796) is 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one.
What is the SMILES notation for 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one?
The canonical SMILES for 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one is Cc1c(N)ccc(=O)n1COC(C)C.
What is the InChIKey of 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one?
The InChIKey is ZOOOYPWOSSYULL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(2)14-6-12-8(3)9(11)4-5-10(12)13/h4-5,7H,6,11H2,1-3H3.
What are the key properties of 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one?
5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one has a molecular weight of 196.25 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-methyl-1-(propan-2-yloxymethyl)pyridin-2-one is sourced from PubChem (CID 130571796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).