morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone

C13H18N4O3 — CID 95841040

IUPACmorpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone
SMILESO=C([C@H]1CN(c2cncnc2)CCO1)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c18-13(16-1-4-19-5-2-16)12-9-17(3-6-20-12)11-7-14-10-15-8-11/h7-8,10,12H,1-6,9H2/t12-/m1/s1
InChIKeyOCCDVAWLJRAMDB-GFCCVEGCSA-N
MW278.31 g/mol
LogP-0.46
Rot. Bonds2

About morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone

morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone (PubChem CID 95841040) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone
PubChem CID95841040
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Namemorpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone
SMILESO=C([C@H]1CN(c2cncnc2)CCO1)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c18-13(16-1-4-19-5-2-16)12-9-17(3-6-20-12)11-7-14-10-15-8-11/h7-8,10,12H,1-6,9H2/t12-/m1/s1
InChIKeyOCCDVAWLJRAMDB-GFCCVEGCSA-N
XLogP-0.46
TPSA67.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 5-0.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-pyrimidin-5-yl-N-(1,3-thiazol-2-yl)morpholine-2-carboxamide
CID 127244733
morpholin-4-yl-[4-[3-(trifluoromethyl)-2-pyridinyl]morpholin-2-yl]methanone
CID 155981081
(2R)-N-(pyridin-3-ylmethyl)-4-pyrimidin-5-ylmorpholine-2-carboxamide
CID 95826619
[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)morpholin-2-yl]-morpholin-4-ylmethanone
CID 155981539
morpholin-4-yl(oxetan-2-yl)methanone
CID 130874953
[4-(6-bromo-1,3-benzothiazol-2-yl)morpholin-2-yl]-morpholin-4-ylmethanone
CID 155981583
N-[(1-methylimidazol-2-yl)methyl]-4-pyrimidin-5-ylmorpholine-2-carboxamide
CID 110257983
(2R)-4-phenylmorpholine-2-carboxylic acid
CID 95804269
[4-(6-methoxyquinolin-2-yl)morpholin-2-yl]-morpholin-4-ylmethanone
CID 163346353
[4-(5-chloropyrimidin-2-yl)morpholin-2-yl]-pyrrolidin-1-ylmethanone
CID 155799926
[4-(3-bromo-4-pyridinyl)morpholin-2-yl]-pyrrolidin-1-ylmethanone
CID 163343615
morpholin-4-yl-(1-pyridin-4-ylazetidin-3-yl)methanone
CID 163357808

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone (CID 95841040) is morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone is O=C([C@H]1CN(c2cncnc2)CCO1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone?
The InChIKey is OCCDVAWLJRAMDB-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H18N4O3/c18-13(16-1-4-19-5-2-16)12-9-17(3-6-20-12)11-7-14-10-15-8-11/h7-8,10,12H,1-6,9H2/t12-/m1/s1.
What are the key properties of morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone?
morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone has a molecular weight of 278.31 g/mol, XLogP of -0.46, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[(2R)-4-pyrimidin-5-ylmorpholin-2-yl]methanone is sourced from PubChem (CID 95841040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).