4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine

C20H20N6O3 — CID 118869480

IUPAC4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
SMILESCc1cc(COc2cc(N3CCOCC3)nc3c(-c4ccn[nH]4)nccc23)no1
InChIInChI=1S/C20H20N6O3/c1-13-10-14(25-29-13)12-28-17-11-18(26-6-8-27-9-7-26)23-19-15(17)2-4-21-20(19)16-3-5-22-24-16/h2-5,10-11H,6-9,12H2,1H3,(H,22,24)
InChIKeyMUQALKPGDLZOJG-UHFFFAOYSA-N
MW392.42 g/mol
LogP2.73
Rot. Bonds5

About 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine

4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine (PubChem CID 118869480) has the molecular formula C20H20N6O3 and a molecular weight of 392.42 g/mol. Its IUPAC name is 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
PubChem CID118869480
Molecular FormulaC20H20N6O3
Molecular Weight392.42 g/mol
Exact Mass392.16
IUPAC Name4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
SMILESCc1cc(COc2cc(N3CCOCC3)nc3c(-c4ccn[nH]4)nccc23)no1
InChIInChI=1S/C20H20N6O3/c1-13-10-14(25-29-13)12-28-17-11-18(26-6-8-27-9-7-26)23-19-15(17)2-4-21-20(19)16-3-5-22-24-16/h2-5,10-11H,6-9,12H2,1H3,(H,22,24)
InChIKeyMUQALKPGDLZOJG-UHFFFAOYSA-N
XLogP2.73
TPSA102.19 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.42
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The IUPAC name of 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine (CID 118869480) is 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine.
What is the SMILES notation for 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The canonical SMILES for 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine is Cc1cc(COc2cc(N3CCOCC3)nc3c(-c4ccn[nH]4)nccc23)no1.
What is the InChIKey of 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The InChIKey is MUQALKPGDLZOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O3/c1-13-10-14(25-29-13)12-28-17-11-18(26-6-8-27-9-7-26)23-19-15(17)2-4-21-20(19)16-3-5-22-24-16/h2-5,10-11H,6-9,12H2,1H3,(H,22,24).
What are the key properties of 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine has a molecular weight of 392.42 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine is sourced from PubChem (CID 118869480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).