3-ethenyl-4-(methylamino)-1H-pyridin-2-one

C8H10N2O — CID 123778572

IUPAC3-ethenyl-4-(methylamino)-1H-pyridin-2-one
SMILESC=Cc1c(NC)cc[nH]c1=O
InChIInChI=1S/C8H10N2O/c1-3-6-7(9-2)4-5-10-8(6)11/h3-5H,1H2,2H3,(H2,9,10,11)
InChIKeyGJKHIZBRVFTBAQ-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.06
Rot. Bonds2

About 3-ethenyl-4-(methylamino)-1H-pyridin-2-one

3-ethenyl-4-(methylamino)-1H-pyridin-2-one (PubChem CID 123778572) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-ethenyl-4-(methylamino)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-ethenyl-4-(methylamino)-1H-pyridin-2-one
PubChem CID123778572
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-ethenyl-4-(methylamino)-1H-pyridin-2-one
SMILESC=Cc1c(NC)cc[nH]c1=O
InChIInChI=1S/C8H10N2O/c1-3-6-7(9-2)4-5-10-8(6)11/h3-5H,1H2,2H3,(H2,9,10,11)
InChIKeyGJKHIZBRVFTBAQ-UHFFFAOYSA-N
XLogP1.06
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-4-(methylamino)-1H-pyridin-2-one?
The IUPAC name of 3-ethenyl-4-(methylamino)-1H-pyridin-2-one (CID 123778572) is 3-ethenyl-4-(methylamino)-1H-pyridin-2-one.
What is the SMILES notation for 3-ethenyl-4-(methylamino)-1H-pyridin-2-one?
The canonical SMILES for 3-ethenyl-4-(methylamino)-1H-pyridin-2-one is C=Cc1c(NC)cc[nH]c1=O.
What is the InChIKey of 3-ethenyl-4-(methylamino)-1H-pyridin-2-one?
The InChIKey is GJKHIZBRVFTBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-3-6-7(9-2)4-5-10-8(6)11/h3-5H,1H2,2H3,(H2,9,10,11).
What are the key properties of 3-ethenyl-4-(methylamino)-1H-pyridin-2-one?
3-ethenyl-4-(methylamino)-1H-pyridin-2-one has a molecular weight of 150.18 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-4-(methylamino)-1H-pyridin-2-one is sourced from PubChem (CID 123778572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).