2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one

C19H19FN2O3 — CID 142756766

IUPAC2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCc1cc2c(c(-c3ccc(F)cc3)n1)C(=O)N(C1OCCO1)C(C)C2
InChIInChI=1S/C19H19FN2O3/c1-11-9-14-10-12(2)22(19-24-7-8-25-19)18(23)16(14)17(21-11)13-3-5-15(20)6-4-13/h3-6,9,12,19H,7-8,10H2,1-2H3
InChIKeyHEQDFUTVGTVIPC-UHFFFAOYSA-N
MW342.37 g/mol
LogP2.91
Rot. Bonds2

About 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one

2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one (PubChem CID 142756766) has the molecular formula C19H19FN2O3 and a molecular weight of 342.37 g/mol. Its IUPAC name is 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one
PubChem CID142756766
Molecular FormulaC19H19FN2O3
Molecular Weight342.37 g/mol
Exact Mass342.14
IUPAC Name2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCc1cc2c(c(-c3ccc(F)cc3)n1)C(=O)N(C1OCCO1)C(C)C2
InChIInChI=1S/C19H19FN2O3/c1-11-9-14-10-12(2)22(19-24-7-8-25-19)18(23)16(14)17(21-11)13-3-5-15(20)6-4-13/h3-6,9,12,19H,7-8,10H2,1-2H3
InChIKeyHEQDFUTVGTVIPC-UHFFFAOYSA-N
XLogP2.91
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-(4-fluorophenyl)-6-methyl-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2,7-naphthyridin-1-one
CID 25051126
6-methyl-4-phenyl-1H-furo[3,4-c]pyridin-3-one
CID 102380561
4-(4-fluorophenyl)-2,5-dimethyl-1H-pyrimidin-6-one
CID 135549350
2-(4-fluorophenyl)-4-methyl-1H-pyrimidin-6-one
CID 135629608
2-(4-fluorophenyl)-7-methyl-3-(6-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine
CID 169001953
(7S)-2-(4-fluorophenyl)-7-methyl-3-(6-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine
CID 169306075
6-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyridazin-3-one
CID 20569973
(6Z)-5-[2-(difluoromethyl)-6-methyl-4-pyridinyl]-4-(4-fluorophenyl)-6-hydrazinylidenepyrimidine-1,2-diamine
CID 168893304
1-(4,6-dimethylpyrimidin-2-yl)-3-(4-fluorophenyl)pyrazol-4-amine
CID 83203239
[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]-[(3R)-3-methylmorpholin-4-yl]methanone
CID 94095663
2,3,5,6-tetrakis(4-fluorophenyl)pyrazine
CID 132966321
(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one
CID 58179266

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one?
The IUPAC name of 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one (CID 142756766) is 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one.
What is the SMILES notation for 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one?
The canonical SMILES for 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one is Cc1cc2c(c(-c3ccc(F)cc3)n1)C(=O)N(C1OCCO1)C(C)C2.
What is the InChIKey of 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one?
The InChIKey is HEQDFUTVGTVIPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O3/c1-11-9-14-10-12(2)22(19-24-7-8-25-19)18(23)16(14)17(21-11)13-3-5-15(20)6-4-13/h3-6,9,12,19H,7-8,10H2,1-2H3.
What are the key properties of 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one?
2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one has a molecular weight of 342.37 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxolan-2-yl)-8-(4-fluorophenyl)-3,6-dimethyl-3,4-dihydro-2,7-naphthyridin-1-one is sourced from PubChem (CID 142756766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).