(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone

C11H15N3O3 — CID 91628566

IUPAC(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone
SMILESCOc1cc(C(=O)N2COCC2(C)C)ncn1
InChIInChI=1S/C11H15N3O3/c1-11(2)5-17-7-14(11)10(15)8-4-9(16-3)13-6-12-8/h4,6H,5,7H2,1-3H3
InChIKeyFSAZWVGPAMVJQF-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.69
Rot. Bonds2

About (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone

(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone (PubChem CID 91628566) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone.

Molecular Properties

Compound Name(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone
PubChem CID91628566
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone
SMILESCOc1cc(C(=O)N2COCC2(C)C)ncn1
InChIInChI=1S/C11H15N3O3/c1-11(2)5-17-7-14(11)10(15)8-4-9(16-3)13-6-12-8/h4,6H,5,7H2,1-3H3
InChIKeyFSAZWVGPAMVJQF-UHFFFAOYSA-N
XLogP0.69
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone?
The IUPAC name of (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone (CID 91628566) is (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone.
What is the SMILES notation for (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone?
The canonical SMILES for (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone is COc1cc(C(=O)N2COCC2(C)C)ncn1.
What is the InChIKey of (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone?
The InChIKey is FSAZWVGPAMVJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-11(2)5-17-7-14(11)10(15)8-4-9(16-3)13-6-12-8/h4,6H,5,7H2,1-3H3.
What are the key properties of (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone?
(4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone has a molecular weight of 237.26 g/mol, XLogP of 0.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-dimethyl-1,3-oxazolidin-3-yl)-(6-methoxypyrimidin-4-yl)methanone is sourced from PubChem (CID 91628566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).