2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one

C17H17FN2O — CID 24772896

IUPAC2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCCN1CCc2cc(C)nc(-c3ccc(F)cc3)c2C1=O
InChIInChI=1S/C17H17FN2O/c1-3-20-9-8-13-10-11(2)19-16(15(13)17(20)21)12-4-6-14(18)7-5-12/h4-7,10H,3,8-9H2,1-2H3
InChIKeyRHUGZMNGAJDGBN-UHFFFAOYSA-N
MW284.33 g/mol
LogP3.21
Rot. Bonds2

About 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one

2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one (PubChem CID 24772896) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one
PubChem CID24772896
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC Name2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCCN1CCc2cc(C)nc(-c3ccc(F)cc3)c2C1=O
InChIInChI=1S/C17H17FN2O/c1-3-20-9-8-13-10-11(2)19-16(15(13)17(20)21)12-4-6-14(18)7-5-12/h4-7,10H,3,8-9H2,1-2H3
InChIKeyRHUGZMNGAJDGBN-UHFFFAOYSA-N
XLogP3.21
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one?
The IUPAC name of 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one (CID 24772896) is 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one.
What is the SMILES notation for 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one?
The canonical SMILES for 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one is CCN1CCc2cc(C)nc(-c3ccc(F)cc3)c2C1=O.
What is the InChIKey of 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one?
The InChIKey is RHUGZMNGAJDGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O/c1-3-20-9-8-13-10-11(2)19-16(15(13)17(20)21)12-4-6-14(18)7-5-12/h4-7,10H,3,8-9H2,1-2H3.
What are the key properties of 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one?
2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one has a molecular weight of 284.33 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-8-(4-fluorophenyl)-6-methyl-3,4-dihydro-2,7-naphthyridin-1-one is sourced from PubChem (CID 24772896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).