1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one

C15H21N3O — CID 22753554

IUPAC1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one
SMILESCc1nc2c(ccc(=O)n2CCN(C)C)c(C)c1C
InChIInChI=1S/C15H21N3O/c1-10-11(2)13-6-7-14(19)18(9-8-17(4)5)15(13)16-12(10)3/h6-7H,8-9H2,1-5H3
InChIKeyUUPIRAARKFHUQY-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.88
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one

1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one (PubChem CID 22753554) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one
PubChem CID22753554
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one
SMILESCc1nc2c(ccc(=O)n2CCN(C)C)c(C)c1C
InChIInChI=1S/C15H21N3O/c1-10-11(2)13-6-7-14(19)18(9-8-17(4)5)15(13)16-12(10)3/h6-7H,8-9H2,1-5H3
InChIKeyUUPIRAARKFHUQY-UHFFFAOYSA-N
XLogP1.88
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one (CID 22753554) is 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one is Cc1nc2c(ccc(=O)n2CCN(C)C)c(C)c1C.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one?
The InChIKey is UUPIRAARKFHUQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-10-11(2)13-6-7-14(19)18(9-8-17(4)5)15(13)16-12(10)3/h6-7H,8-9H2,1-5H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one?
1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one has a molecular weight of 259.35 g/mol, XLogP of 1.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-5,6,7-trimethyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 22753554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).