(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine

C15H21N5O2 — CID 95285130

IUPAC(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
SMILESCc1cnn(C[C@H]2CN(Cc3noc(C4CC4)n3)CCO2)c1
InChIInChI=1S/C15H21N5O2/c1-11-6-16-20(7-11)9-13-8-19(4-5-21-13)10-14-17-15(22-18-14)12-2-3-12/h6-7,12-13H,2-5,8-10H2,1H3/t13-/m1/s1
InChIKeyPNMZJUYNNKVCEJ-CYBMUJFWSA-N
MW303.37 g/mol
LogP1.35
Rot. Bonds5

About (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine

(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine (PubChem CID 95285130) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine.

Molecular Properties

Compound Name(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
PubChem CID95285130
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
SMILESCc1cnn(C[C@H]2CN(Cc3noc(C4CC4)n3)CCO2)c1
InChIInChI=1S/C15H21N5O2/c1-11-6-16-20(7-11)9-13-8-19(4-5-21-13)10-14-17-15(22-18-14)12-2-3-12/h6-7,12-13H,2-5,8-10H2,1H3/t13-/m1/s1
InChIKeyPNMZJUYNNKVCEJ-CYBMUJFWSA-N
XLogP1.35
TPSA69.21 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine with MolForge

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Related Compounds

4-[(5-Propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53557636
4-[(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53559146
4-[[5-(2-Methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53559178
4-[(5-Methyl-1,2,4-oxadiazol-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53561788
4-[[3-(2-Methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53562867
4-[(5-Propyl-1,2,4-oxadiazol-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53562875
4-[(5-Cyclopropyl-4-methyl-1,2,4-triazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53562887
4-[(5-Tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53562941
4-[(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 53564832
4-[(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53565426
4-[(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53565860
4-[(3-Methyl-1,2,4-oxadiazol-5-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53566159

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine?
The IUPAC name of (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine (CID 95285130) is (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine.
What is the SMILES notation for (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine?
The canonical SMILES for (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine is Cc1cnn(C[C@H]2CN(Cc3noc(C4CC4)n3)CCO2)c1.
What is the InChIKey of (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine?
The InChIKey is PNMZJUYNNKVCEJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-6-16-20(7-11)9-13-8-19(4-5-21-13)10-14-17-15(22-18-14)12-2-3-12/h6-7,12-13H,2-5,8-10H2,1H3/t13-/m1/s1.
What are the key properties of (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine?
(2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine has a molecular weight of 303.37 g/mol, XLogP of 1.35, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine is sourced from PubChem (CID 95285130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).