3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole

C21H18N6O — CID 56857215

IUPAC3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole
SMILESCc1ncc2c(c1-c1noc(-c3ccncc3)n1)CCN(c1ccccn1)C2
InChIInChI=1S/C21H18N6O/c1-14-19(20-25-21(28-26-20)15-5-9-22-10-6-15)17-7-11-27(13-16(17)12-24-14)18-4-2-3-8-23-18/h2-6,8-10,12H,7,11,13H2,1H3
InChIKeyWQUPJSXMOLEYIJ-UHFFFAOYSA-N
MW370.42 g/mol
LogP3.46
Rot. Bonds3

About 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole

3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole (PubChem CID 56857215) has the molecular formula C21H18N6O and a molecular weight of 370.42 g/mol. Its IUPAC name is 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole
PubChem CID56857215
Molecular FormulaC21H18N6O
Molecular Weight370.42 g/mol
Exact Mass370.15
IUPAC Name3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole
SMILESCc1ncc2c(c1-c1noc(-c3ccncc3)n1)CCN(c1ccccn1)C2
InChIInChI=1S/C21H18N6O/c1-14-19(20-25-21(28-26-20)15-5-9-22-10-6-15)17-7-11-27(13-16(17)12-24-14)18-4-2-3-8-23-18/h2-6,8-10,12H,7,11,13H2,1H3
InChIKeyWQUPJSXMOLEYIJ-UHFFFAOYSA-N
XLogP3.46
TPSA80.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole with MolForge

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Launch Full Analysis

Related Compounds

3-(4-methoxyphenyl)-5-[6-(4-pyridin-2-ylpiperazin-1-yl)-3-pyridinyl]-1,2,4-oxadiazole
CID 53126709
3-(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)-5-(2-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole;hydrochloride
CID 166597730
1H-imidazol-5-yl-[6-methyl-5-(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
CID 28881344
8-fluoro-7-methyl-2-(5-pyridin-4-yl-2-pyridinyl)-3,4-dihydro-1H-isoquinoline
CID 166359802
cyclobutyl-[6-methyl-5-(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
CID 31162028
[6-methyl-5-[5-(1-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-phenylmethanone
CID 29086016
ethane;3-pyridin-4-yl-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole
CID 143910207
3-(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)-5-[3-(1,2,4-triazol-4-yl)phenyl]-1,2,4-oxadiazole
CID 28956775
3-[3-(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
CID 28871798
N,N-dimethyl-2-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methoxy]ethanamine
CID 97463744
1-[5-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-4-ol
CID 56769912
2-(2-pyridin-2-yl-6-pyridin-4-ylpyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline
CID 4682397

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole?
The IUPAC name of 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole (CID 56857215) is 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole.
What is the SMILES notation for 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole?
The canonical SMILES for 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole is Cc1ncc2c(c1-c1noc(-c3ccncc3)n1)CCN(c1ccccn1)C2.
What is the InChIKey of 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole?
The InChIKey is WQUPJSXMOLEYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N6O/c1-14-19(20-25-21(28-26-20)15-5-9-22-10-6-15)17-7-11-27(13-16(17)12-24-14)18-4-2-3-8-23-18/h2-6,8-10,12H,7,11,13H2,1H3.
What are the key properties of 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole?
3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole has a molecular weight of 370.42 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)-5-pyridin-4-yl-1,2,4-oxadiazole is sourced from PubChem (CID 56857215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).