1-methyl-5-(propan-2-ylamino)pyridin-2-one

C9H14N2O — CID 60930650

IUPAC1-methyl-5-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1ccc(=O)n(C)c1
InChIInChI=1S/C9H14N2O/c1-7(2)10-8-4-5-9(12)11(3)6-8/h4-7,10H,1-3H3
InChIKeyYDTPRNZQWVXUQS-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.21
Rot. Bonds2

About 1-methyl-5-(propan-2-ylamino)pyridin-2-one

1-methyl-5-(propan-2-ylamino)pyridin-2-one (PubChem CID 60930650) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-methyl-5-(propan-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-(propan-2-ylamino)pyridin-2-one
PubChem CID60930650
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-methyl-5-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1ccc(=O)n(C)c1
InChIInChI=1S/C9H14N2O/c1-7(2)10-8-4-5-9(12)11(3)6-8/h4-7,10H,1-3H3
InChIKeyYDTPRNZQWVXUQS-UHFFFAOYSA-N
XLogP1.21
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(propan-2-ylamino)pyridin-2-one?
The IUPAC name of 1-methyl-5-(propan-2-ylamino)pyridin-2-one (CID 60930650) is 1-methyl-5-(propan-2-ylamino)pyridin-2-one.
What is the SMILES notation for 1-methyl-5-(propan-2-ylamino)pyridin-2-one?
The canonical SMILES for 1-methyl-5-(propan-2-ylamino)pyridin-2-one is CC(C)Nc1ccc(=O)n(C)c1.
What is the InChIKey of 1-methyl-5-(propan-2-ylamino)pyridin-2-one?
The InChIKey is YDTPRNZQWVXUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(2)10-8-4-5-9(12)11(3)6-8/h4-7,10H,1-3H3.
What are the key properties of 1-methyl-5-(propan-2-ylamino)pyridin-2-one?
1-methyl-5-(propan-2-ylamino)pyridin-2-one has a molecular weight of 166.22 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(propan-2-ylamino)pyridin-2-one is sourced from PubChem (CID 60930650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).