(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone

C11H15N3O4 — CID 3286661

IUPAC(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone
SMILESCOc1cc(C(=O)N2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H15N3O4/c1-16-9-7-8(12-11(13-9)17-2)10(15)14-3-5-18-6-4-14/h7H,3-6H2,1-2H3
InChIKeyYWOAPQGNRUPNAG-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.03
Rot. Bonds3

About (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone

(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone (PubChem CID 3286661) has the molecular formula C11H15N3O4 and a molecular weight of 253.26 g/mol. Its IUPAC name is (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone
PubChem CID3286661
Molecular FormulaC11H15N3O4
Molecular Weight253.26 g/mol
Exact Mass253.11
IUPAC Name(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone
SMILESCOc1cc(C(=O)N2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H15N3O4/c1-16-9-7-8(12-11(13-9)17-2)10(15)14-3-5-18-6-4-14/h7H,3-6H2,1-2H3
InChIKeyYWOAPQGNRUPNAG-UHFFFAOYSA-N
XLogP-0.03
TPSA73.78 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(dimethylamino)-N-ethyl-6-methoxypyrimidine-4-carboxamide
CID 122180007
6-methoxy-N-(2,2,2-trifluoroethyl)pyrimidine-4-carboxamide
CID 91628546
6-Methoxy-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyrimidine-4-carboxylic acid
CID 171767601
(4,4-Dimethyloxazolidin-3-yl)(6-methoxypyrimidin-4-yl)methanone
CID 91628566
(6-Ethoxypyrimidin-4-yl)(4-(methylsulfonyl)piperazin-1-yl)methanone
CID 91816284
6-ethoxy-N-(2,2,2-trifluoroethyl)pyrimidine-4-carboxamide
CID 91816289
2,6-dimethoxy-N-[2-[(2S)-4-methylmorpholin-2-yl]ethyl]pyrimidine-4-carboxamide
CID 95229551
[4-(Cyclopentylmethoxy)piperidin-1-yl]-(6-methoxypyrimidin-4-yl)methanone
CID 138026458
N-[[(2R)-1-cyclopropylpiperidin-2-yl]methyl]-6-methoxypyrimidine-4-carboxamide
CID 164635280
6-methoxy-N-[[(3R)-1-(2-methylpropyl)piperidin-3-yl]methyl]pyrimidine-4-carboxamide
CID 164636605
(6-methoxypyrimidin-4-yl)-[(3S)-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperazin-1-yl]methanone
CID 171359869
(6-Methoxy-2-piperazin-1-ylpyrimidin-4-yl)-piperidin-1-ylmethanone
CID 177658229

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone (CID 3286661) is (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone is COc1cc(C(=O)N2CCOCC2)nc(OC)n1.
What is the InChIKey of (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone?
The InChIKey is YWOAPQGNRUPNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4/c1-16-9-7-8(12-11(13-9)17-2)10(15)14-3-5-18-6-4-14/h7H,3-6H2,1-2H3.
What are the key properties of (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone?
(2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone has a molecular weight of 253.26 g/mol, XLogP of -0.03, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxypyrimidin-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 3286661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).