[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone

C23H19FN4O4 — CID 146469058

IUPAC[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone
SMILESCc1onc(-c2ccc(F)cc2)c1COc1ccc2c(n1)CCN(C(=O)c1ccno1)C2
InChIInChI=1S/C23H19FN4O4/c1-14-18(22(27-31-14)15-2-5-17(24)6-3-15)13-30-21-7-4-16-12-28(11-9-19(16)26-21)23(29)20-8-10-25-32-20/h2-8,10H,9,11-13H2,1H3
InChIKeyUMFHAUNGEIGDID-UHFFFAOYSA-N
MW434.43 g/mol
LogP3.95
Rot. Bonds5

About [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone

[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone (PubChem CID 146469058) has the molecular formula C23H19FN4O4 and a molecular weight of 434.43 g/mol. Its IUPAC name is [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone.

Molecular Properties

Compound Name[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone
PubChem CID146469058
Molecular FormulaC23H19FN4O4
Molecular Weight434.43 g/mol
Exact Mass434.14
IUPAC Name[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone
SMILESCc1onc(-c2ccc(F)cc2)c1COc1ccc2c(n1)CCN(C(=O)c1ccno1)C2
InChIInChI=1S/C23H19FN4O4/c1-14-18(22(27-31-14)15-2-5-17(24)6-3-15)13-30-21-7-4-16-12-28(11-9-19(16)26-21)23(29)20-8-10-25-32-20/h2-8,10H,9,11-13H2,1H3
InChIKeyUMFHAUNGEIGDID-UHFFFAOYSA-N
XLogP3.95
TPSA94.49 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.43
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone?
The IUPAC name of [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone (CID 146469058) is [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone.
What is the SMILES notation for [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone?
The canonical SMILES for [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone is Cc1onc(-c2ccc(F)cc2)c1COc1ccc2c(n1)CCN(C(=O)c1ccno1)C2.
What is the InChIKey of [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone?
The InChIKey is UMFHAUNGEIGDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4O4/c1-14-18(22(27-31-14)15-2-5-17(24)6-3-15)13-30-21-7-4-16-12-28(11-9-19(16)26-21)23(29)20-8-10-25-32-20/h2-8,10H,9,11-13H2,1H3.
What are the key properties of [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone?
[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone has a molecular weight of 434.43 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(1,2-oxazol-5-yl)methanone is sourced from PubChem (CID 146469058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).