1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one

C14H21N3O — CID 23335380

IUPAC1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one
SMILESCc1cc(C)c2c(n1)N(CCN(C)C)C(=O)CC2
InChIInChI=1S/C14H21N3O/c1-10-9-11(2)15-14-12(10)5-6-13(18)17(14)8-7-16(3)4/h9H,5-8H2,1-4H3
InChIKeyKNDFPRAPQJJNAT-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.54
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one

1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one (PubChem CID 23335380) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one
PubChem CID23335380
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one
SMILESCc1cc(C)c2c(n1)N(CCN(C)C)C(=O)CC2
InChIInChI=1S/C14H21N3O/c1-10-9-11(2)15-14-12(10)5-6-13(18)17(14)8-7-16(3)4/h9H,5-8H2,1-4H3
InChIKeyKNDFPRAPQJJNAT-UHFFFAOYSA-N
XLogP1.54
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.54
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]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one (CID 23335380) is 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one is Cc1cc(C)c2c(n1)N(CCN(C)C)C(=O)CC2.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one?
The InChIKey is KNDFPRAPQJJNAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10-9-11(2)15-14-12(10)5-6-13(18)17(14)8-7-16(3)4/h9H,5-8H2,1-4H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one?
1-[2-(dimethylamino)ethyl]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one has a molecular weight of 247.34 g/mol, XLogP of 1.54, 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]-5,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one is sourced from PubChem (CID 23335380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).