(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone

C11H15N3O2 — CID 166121794

IUPAC(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone
SMILESO=C(c1cnn(C2CC2)c1)[C@H]1CNCCO1
InChIInChI=1S/C11H15N3O2/c15-11(10-6-12-3-4-16-10)8-5-13-14(7-8)9-1-2-9/h5,7,9-10,12H,1-4,6H2/t10-/m1/s1
InChIKeyXNPBPVLPLXELDT-SNVBAGLBSA-N
MW221.26 g/mol
LogP0.39
Rot. Bonds3

About (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone

(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone (PubChem CID 166121794) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone.

Molecular Properties

Compound Name(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone
PubChem CID166121794
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone
SMILESO=C(c1cnn(C2CC2)c1)[C@H]1CNCCO1
InChIInChI=1S/C11H15N3O2/c15-11(10-6-12-3-4-16-10)8-5-13-14(7-8)9-1-2-9/h5,7,9-10,12H,1-4,6H2/t10-/m1/s1
InChIKeyXNPBPVLPLXELDT-SNVBAGLBSA-N
XLogP0.39
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone?
The IUPAC name of (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone (CID 166121794) is (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone.
What is the SMILES notation for (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone?
The canonical SMILES for (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone is O=C(c1cnn(C2CC2)c1)[C@H]1CNCCO1.
What is the InChIKey of (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone?
The InChIKey is XNPBPVLPLXELDT-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-11(10-6-12-3-4-16-10)8-5-13-14(7-8)9-1-2-9/h5,7,9-10,12H,1-4,6H2/t10-/m1/s1.
What are the key properties of (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone?
(1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone has a molecular weight of 221.26 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopropylpyrazol-4-yl)-[(2R)-morpholin-2-yl]methanone is sourced from PubChem (CID 166121794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).