(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone

C12H14N4O3 — CID 124981377

IUPAC(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1ocnc1C(=O)N1CCOC[C@H]1c1ccn[nH]1
InChIInChI=1S/C12H14N4O3/c1-8-11(13-7-19-8)12(17)16-4-5-18-6-10(16)9-2-3-14-15-9/h2-3,7,10H,4-6H2,1H3,(H,14,15)/t10-/m0/s1
InChIKeyMPURJYNZPDLMDQ-JTQLQIEISA-N
MW262.27 g/mol
LogP0.92
Rot. Bonds2

About (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone

(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone (PubChem CID 124981377) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone
PubChem CID124981377
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC Name(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1ocnc1C(=O)N1CCOC[C@H]1c1ccn[nH]1
InChIInChI=1S/C12H14N4O3/c1-8-11(13-7-19-8)12(17)16-4-5-18-6-10(16)9-2-3-14-15-9/h2-3,7,10H,4-6H2,1H3,(H,14,15)/t10-/m0/s1
InChIKeyMPURJYNZPDLMDQ-JTQLQIEISA-N
XLogP0.92
TPSA84.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The IUPAC name of (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone (CID 124981377) is (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The canonical SMILES for (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone is Cc1ocnc1C(=O)N1CCOC[C@H]1c1ccn[nH]1.
What is the InChIKey of (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone?
The InChIKey is MPURJYNZPDLMDQ-JTQLQIEISA-N. The full InChI is InChI=1S/C12H14N4O3/c1-8-11(13-7-19-8)12(17)16-4-5-18-6-10(16)9-2-3-14-15-9/h2-3,7,10H,4-6H2,1H3,(H,14,15)/t10-/m0/s1.
What are the key properties of (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone?
(5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone has a molecular weight of 262.27 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,3-oxazol-4-yl)-[(3R)-3-(1H-pyrazol-5-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 124981377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).