(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one

C19H17N3O4 — CID 71241901

IUPAC(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(-c2cc(OC[C@H]3CNC(=O)O3)c3cccnc3c2)cn1
InChIInChI=1S/C19H17N3O4/c1-24-18-5-4-12(9-21-18)13-7-16-15(3-2-6-20-16)17(8-13)25-11-14-10-22-19(23)26-14/h2-9,14H,10-11H2,1H3,(H,22,23)/t14-/m1/s1
InChIKeyXZBFFMZZJJMZTH-CQSZACIVSA-N
MW351.36 g/mol
LogP2.79
Rot. Bonds5

About (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one

(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one (PubChem CID 71241901) has the molecular formula C19H17N3O4 and a molecular weight of 351.36 g/mol. Its IUPAC name is (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one
PubChem CID71241901
Molecular FormulaC19H17N3O4
Molecular Weight351.36 g/mol
Exact Mass351.12
IUPAC Name(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(-c2cc(OC[C@H]3CNC(=O)O3)c3cccnc3c2)cn1
InChIInChI=1S/C19H17N3O4/c1-24-18-5-4-12(9-21-18)13-7-16-15(3-2-6-20-16)17(8-13)25-11-14-10-22-19(23)26-14/h2-9,14H,10-11H2,1H3,(H,22,23)/t14-/m1/s1
InChIKeyXZBFFMZZJJMZTH-CQSZACIVSA-N
XLogP2.79
TPSA82.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one (CID 71241901) is (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one is COc1ccc(-c2cc(OC[C@H]3CNC(=O)O3)c3cccnc3c2)cn1.
What is the InChIKey of (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one?
The InChIKey is XZBFFMZZJJMZTH-CQSZACIVSA-N. The full InChI is InChI=1S/C19H17N3O4/c1-24-18-5-4-12(9-21-18)13-7-16-15(3-2-6-20-16)17(8-13)25-11-14-10-22-19(23)26-14/h2-9,14H,10-11H2,1H3,(H,22,23)/t14-/m1/s1.
What are the key properties of (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one?
(5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one has a molecular weight of 351.36 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 71241901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).