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

C19H18N6O2 — CID 118890816

IUPAC(3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
SMILESC[C@@H]1COCCN1c1cc(-c2ncco2)c2ccnc(-c3ccn[nH]3)c2n1
InChIInChI=1S/C19H18N6O2/c1-12-11-26-9-7-25(12)16-10-14(19-21-6-8-27-19)13-2-4-20-18(17(13)23-16)15-3-5-22-24-15/h2-6,8,10,12H,7,9,11H2,1H3,(H,22,24)/t12-/m1/s1
InChIKeyKLPJEEIYGVJFCL-GFCCVEGCSA-N
MW362.39 g/mol
LogP2.90
Rot. Bonds3

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

(3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine (PubChem CID 118890816) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine.

Molecular Properties

Compound Name(3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
PubChem CID118890816
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name(3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
SMILESC[C@@H]1COCCN1c1cc(-c2ncco2)c2ccnc(-c3ccn[nH]3)c2n1
InChIInChI=1S/C19H18N6O2/c1-12-11-26-9-7-25(12)16-10-14(19-21-6-8-27-19)13-2-4-20-18(17(13)23-16)15-3-5-22-24-15/h2-6,8,10,12H,7,9,11H2,1H3,(H,22,24)/t12-/m1/s1
InChIKeyKLPJEEIYGVJFCL-GFCCVEGCSA-N
XLogP2.90
TPSA92.96 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The IUPAC name of (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine (CID 118890816) is (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine.
What is the SMILES notation for (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The canonical SMILES for (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine is C[C@@H]1COCCN1c1cc(-c2ncco2)c2ccnc(-c3ccn[nH]3)c2n1.
What is the InChIKey of (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
The InChIKey is KLPJEEIYGVJFCL-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-12-11-26-9-7-25(12)16-10-14(19-21-6-8-27-19)13-2-4-20-18(17(13)23-16)15-3-5-22-24-15/h2-6,8,10,12H,7,9,11H2,1H3,(H,22,24)/t12-/m1/s1.
What are the key properties of (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine?
(3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine has a molecular weight of 362.39 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-4-[4-(1,3-oxazol-2-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine is sourced from PubChem (CID 118890816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).