4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one

C9H14N2O — CID 89427682

IUPAC4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one
SMILESCCNc1cc(C)[nH]c(=O)c1C
InChIInChI=1S/C9H14N2O/c1-4-10-8-5-6(2)11-9(12)7(8)3/h5H,4H2,1-3H3,(H2,10,11,12)
InChIKeyJOIZYQNCYHDDLE-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.42
Rot. Bonds2

About 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one

4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one (PubChem CID 89427682) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one
PubChem CID89427682
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one
SMILESCCNc1cc(C)[nH]c(=O)c1C
InChIInChI=1S/C9H14N2O/c1-4-10-8-5-6(2)11-9(12)7(8)3/h5H,4H2,1-3H3,(H2,10,11,12)
InChIKeyJOIZYQNCYHDDLE-UHFFFAOYSA-N
XLogP1.42
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one?
The IUPAC name of 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one (CID 89427682) is 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one.
What is the SMILES notation for 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one?
The canonical SMILES for 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one is CCNc1cc(C)[nH]c(=O)c1C.
What is the InChIKey of 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one?
The InChIKey is JOIZYQNCYHDDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-4-10-8-5-6(2)11-9(12)7(8)3/h5H,4H2,1-3H3,(H2,10,11,12).
What are the key properties of 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one?
4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one has a molecular weight of 166.22 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-3,6-dimethyl-1H-pyridin-2-one is sourced from PubChem (CID 89427682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).