5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen

C11H21N3O — CID 176690593

IUPAC5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen
SMILESCCn1cc(NCCN(C)C)ccc1=O.[H][H]
InChIInChI=1S/C11H19N3O.H2/c1-4-14-9-10(5-6-11(14)15)12-7-8-13(2)3;/h5-6,9,12H,4,7-8H2,1-3H3;1H
InChIKeyHYIXDZSUXBVHSC-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.09
Rot. Bonds5

About 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen

5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen (PubChem CID 176690593) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen.

Molecular Properties

Compound Name5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen
PubChem CID176690593
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen
SMILESCCn1cc(NCCN(C)C)ccc1=O.[H][H]
InChIInChI=1S/C11H19N3O.H2/c1-4-14-9-10(5-6-11(14)15)12-7-8-13(2)3;/h5-6,9,12H,4,7-8H2,1-3H3;1H
InChIKeyHYIXDZSUXBVHSC-UHFFFAOYSA-N
XLogP1.09
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen?
The IUPAC name of 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen (CID 176690593) is 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen.
What is the SMILES notation for 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen?
The canonical SMILES for 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen is CCn1cc(NCCN(C)C)ccc1=O.[H][H].
What is the InChIKey of 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen?
The InChIKey is HYIXDZSUXBVHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O.H2/c1-4-14-9-10(5-6-11(14)15)12-7-8-13(2)3;/h5-6,9,12H,4,7-8H2,1-3H3;1H.
What are the key properties of 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen?
5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen has a molecular weight of 211.31 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(dimethylamino)ethylamino]-1-ethylpyridin-2-one;molecular hydrogen is sourced from PubChem (CID 176690593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).