1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone

C24H21N5O2 — CID 148719871

IUPAC1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone
SMILESCN1CC=C(c2cc(C(=O)Cc3cc4cc(-c5cnco5)cnc4cn3)ccn2)CC1
InChIInChI=1S/C24H21N5O2/c1-29-6-3-16(4-7-29)21-10-17(2-5-26-21)23(30)11-20-9-18-8-19(24-14-25-15-31-24)12-28-22(18)13-27-20/h2-3,5,8-10,12-15H,4,6-7,11H2,1H3
InChIKeyNYWGJSHXQXTELF-UHFFFAOYSA-N
MW411.47 g/mol
LogP3.82
Rot. Bonds5

About 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone

1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone (PubChem CID 148719871) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone.

Molecular Properties

Compound Name1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone
PubChem CID148719871
Molecular FormulaC24H21N5O2
Molecular Weight411.47 g/mol
Exact Mass411.17
IUPAC Name1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone
SMILESCN1CC=C(c2cc(C(=O)Cc3cc4cc(-c5cnco5)cnc4cn3)ccn2)CC1
InChIInChI=1S/C24H21N5O2/c1-29-6-3-16(4-7-29)21-10-17(2-5-26-21)23(30)11-20-9-18-8-19(24-14-25-15-31-24)12-28-22(18)13-27-20/h2-3,5,8-10,12-15H,4,6-7,11H2,1H3
InChIKeyNYWGJSHXQXTELF-UHFFFAOYSA-N
XLogP3.82
TPSA85.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone with MolForge

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Related Compounds

2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-N-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
CID 138591463
2-[3-[6-(tert-butylamino)pyrazin-2-yl]-1,7-naphthyridin-6-yl]-1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]ethanone
CID 159037627
2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-N-[7-(1,3-oxazol-5-yl)quinazolin-2-yl]pyridine-4-carboxamide
CID 138588787
2-[3-(5-methoxy-3-pyridinyl)-1,7-naphthyridin-6-yl]-1-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]ethanone
CID 159031337
1-[5-[6-[2-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]-2-oxoethyl]-1,7-naphthyridin-3-yl]-3-pyridinyl]propan-1-one
CID 159131291
1-[1-(2,2-difluoropropyl)piperidin-4-yl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone
CID 158656022
1-[2-(4,4-dimethylpiperazin-4-ium-1-yl)-4-pyridinyl]-2-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]ethanone;1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]ethanone;1-[2-[4-[4-(4-methylpiperazin-1-yl)benzoyl]piperazin-1-yl]-4-pyridinyl]-2-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]ethanone
CID 159926267
2-[3-[6-(tert-butylamino)pyrazin-2-yl]-1,7-naphthyridin-6-yl]-1-(2-morpholin-4-yl-4-pyridinyl)ethanone
CID 160710808
2-[3-(5-amino-1,3,4-thiadiazol-2-yl)-1,7-naphthyridin-6-yl]-1-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]ethanone
CID 158242202
2-[3-(3-methylimidazol-4-yl)-1,7-naphthyridin-6-yl]-1-[2-(4-propan-2-ylpiperazin-1-yl)-4-pyridinyl]ethanone
CID 148866426
1-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]-2-[3-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1,7-naphthyridin-6-yl]ethanone
CID 161188448
1-[2-(1-methylpiperidin-4-yl)sulfanyl-4-pyridinyl]-2-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]ethanone
CID 148801769

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone?
The IUPAC name of 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone (CID 148719871) is 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone.
What is the SMILES notation for 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone?
The canonical SMILES for 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone is CN1CC=C(c2cc(C(=O)Cc3cc4cc(-c5cnco5)cnc4cn3)ccn2)CC1.
What is the InChIKey of 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone?
The InChIKey is NYWGJSHXQXTELF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-29-6-3-16(4-7-29)21-10-17(2-5-26-21)23(30)11-20-9-18-8-19(24-14-25-15-31-24)12-28-22(18)13-27-20/h2-3,5,8-10,12-15H,4,6-7,11H2,1H3.
What are the key properties of 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone?
1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone has a molecular weight of 411.47 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[3-(1,3-oxazol-5-yl)-1,7-naphthyridin-6-yl]ethanone is sourced from PubChem (CID 148719871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).