(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone

C12H14N4O2 — CID 134793369

IUPAC(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone
SMILESCc1cc2ncc(C(=O)N3CCOCC3)cn2n1
InChIInChI=1S/C12H14N4O2/c1-9-6-11-13-7-10(8-16(11)14-9)12(17)15-2-4-18-5-3-15/h6-8H,2-5H2,1H3
InChIKeyMGOUYQBPAWZCEY-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.51
Rot. Bonds1

About (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone

(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone (PubChem CID 134793369) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone
PubChem CID134793369
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone
SMILESCc1cc2ncc(C(=O)N3CCOCC3)cn2n1
InChIInChI=1S/C12H14N4O2/c1-9-6-11-13-7-10(8-16(11)14-9)12(17)15-2-4-18-5-3-15/h6-8H,2-5H2,1H3
InChIKeyMGOUYQBPAWZCEY-UHFFFAOYSA-N
XLogP0.51
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone (CID 134793369) is (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone is Cc1cc2ncc(C(=O)N3CCOCC3)cn2n1.
What is the InChIKey of (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone?
The InChIKey is MGOUYQBPAWZCEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-9-6-11-13-7-10(8-16(11)14-9)12(17)15-2-4-18-5-3-15/h6-8H,2-5H2,1H3.
What are the key properties of (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone?
(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone has a molecular weight of 246.27 g/mol, XLogP of 0.51, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 134793369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).