[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone

C15H17N5O2 — CID 110115566

IUPAC[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone
SMILESCc1cc(C)nc(C2CN(C(=O)c3ncccn3)CCO2)n1
InChIInChI=1S/C15H17N5O2/c1-10-8-11(2)19-13(18-10)12-9-20(6-7-22-12)15(21)14-16-4-3-5-17-14/h3-5,8,12H,6-7,9H2,1-2H3
InChIKeyQAEVBBQECFNSBX-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.10
Rot. Bonds2

About [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone

[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone (PubChem CID 110115566) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone.

Molecular Properties

Compound Name[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone
PubChem CID110115566
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone
SMILESCc1cc(C)nc(C2CN(C(=O)c3ncccn3)CCO2)n1
InChIInChI=1S/C15H17N5O2/c1-10-8-11(2)19-13(18-10)12-9-20(6-7-22-12)15(21)14-16-4-3-5-17-14/h3-5,8,12H,6-7,9H2,1-2H3
InChIKeyQAEVBBQECFNSBX-UHFFFAOYSA-N
XLogP1.10
TPSA81.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 110115591
[(2R)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrazin-2-ylmethanone
CID 124972759
(2,4-dimethylpyrimidin-5-yl)-[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 110115620
[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-(1,3-thiazol-5-yl)methanone
CID 124971089
(1,3-dimethylpyrazol-4-yl)-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 124990802
1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one
CID 124960101
[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]-quinolin-3-ylmethanone
CID 124959536
[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]-quinolin-5-ylmethanone
CID 124978768
4-methyl-2-[(2S)-4-(quinoline-6-carbonyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 137037891
[(2R)-2-[2-(dimethylamino)pyrimidin-4-yl]morpholin-4-yl]-(2,6-dimethylpyrimidin-4-yl)methanone
CID 129328387
[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]-pyridin-2-ylmethanone
CID 125024334
(5-fluoro-2-methoxyphenyl)-[(2S)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 124963745

Frequently Asked Questions

What is the IUPAC name of [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone?
The IUPAC name of [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone (CID 110115566) is [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone.
What is the SMILES notation for [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone?
The canonical SMILES for [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone is Cc1cc(C)nc(C2CN(C(=O)c3ncccn3)CCO2)n1.
What is the InChIKey of [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone?
The InChIKey is QAEVBBQECFNSBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-10-8-11(2)19-13(18-10)12-9-20(6-7-22-12)15(21)14-16-4-3-5-17-14/h3-5,8,12H,6-7,9H2,1-2H3.
What are the key properties of [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone?
[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone has a molecular weight of 299.33 g/mol, XLogP of 1.10, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone is sourced from PubChem (CID 110115566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).