1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one

C12H18N2O — CID 60932218

IUPAC1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one
SMILESCC(Nc1ccc(=O)n(C)c1)C1(C)CC1
InChIInChI=1S/C12H18N2O/c1-9(12(2)6-7-12)13-10-4-5-11(15)14(3)8-10/h4-5,8-9,13H,6-7H2,1-3H3
InChIKeyLAQGWDZLQAOYJP-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.99
Rot. Bonds3

About 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one

1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one (PubChem CID 60932218) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one
PubChem CID60932218
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one
SMILESCC(Nc1ccc(=O)n(C)c1)C1(C)CC1
InChIInChI=1S/C12H18N2O/c1-9(12(2)6-7-12)13-10-4-5-11(15)14(3)8-10/h4-5,8-9,13H,6-7H2,1-3H3
InChIKeyLAQGWDZLQAOYJP-UHFFFAOYSA-N
XLogP1.99
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one?
The IUPAC name of 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one (CID 60932218) is 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one is CC(Nc1ccc(=O)n(C)c1)C1(C)CC1.
What is the InChIKey of 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one?
The InChIKey is LAQGWDZLQAOYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9(12(2)6-7-12)13-10-4-5-11(15)14(3)8-10/h4-5,8-9,13H,6-7H2,1-3H3.
What are the key properties of 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one?
1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one has a molecular weight of 206.29 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[1-(1-methylcyclopropyl)ethylamino]pyridin-2-one is sourced from PubChem (CID 60932218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).