1-[2-(dimethylamino)ethyl]quinolin-2-one

C13H16N2O — CID 45117450

IUPAC1-[2-(dimethylamino)ethyl]quinolin-2-one
SMILESCN(C)CCn1c(=O)ccc2ccccc21
InChIInChI=1S/C13H16N2O/c1-14(2)9-10-15-12-6-4-3-5-11(12)7-8-13(15)16/h3-8H,9-10H2,1-2H3
InChIKeyGRNJXTHUPZCPBT-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.56
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]quinolin-2-one

1-[2-(dimethylamino)ethyl]quinolin-2-one (PubChem CID 45117450) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]quinolin-2-one.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]quinolin-2-one
PubChem CID45117450
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name1-[2-(dimethylamino)ethyl]quinolin-2-one
SMILESCN(C)CCn1c(=O)ccc2ccccc21
InChIInChI=1S/C13H16N2O/c1-14(2)9-10-15-12-6-4-3-5-11(12)7-8-13(15)16/h3-8H,9-10H2,1-2H3
InChIKeyGRNJXTHUPZCPBT-UHFFFAOYSA-N
XLogP1.56
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]quinolin-2-one?
The IUPAC name of 1-[2-(dimethylamino)ethyl]quinolin-2-one (CID 45117450) is 1-[2-(dimethylamino)ethyl]quinolin-2-one.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]quinolin-2-one?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]quinolin-2-one is CN(C)CCn1c(=O)ccc2ccccc21.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]quinolin-2-one?
The InChIKey is GRNJXTHUPZCPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-14(2)9-10-15-12-6-4-3-5-11(12)7-8-13(15)16/h3-8H,9-10H2,1-2H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]quinolin-2-one?
1-[2-(dimethylamino)ethyl]quinolin-2-one has a molecular weight of 216.28 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]quinolin-2-one is sourced from PubChem (CID 45117450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).