7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine

C12H15N3O — CID 126954741

IUPAC7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(OCC2CC2)n2nc(C)cc2n1
InChIInChI=1S/C12H15N3O/c1-8-6-12(16-7-10-3-4-10)15-11(13-8)5-9(2)14-15/h5-6,10H,3-4,7H2,1-2H3
InChIKeyNROMRGBMWLBBQT-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.13
Rot. Bonds3

About 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine

7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine (PubChem CID 126954741) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
PubChem CID126954741
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(OCC2CC2)n2nc(C)cc2n1
InChIInChI=1S/C12H15N3O/c1-8-6-12(16-7-10-3-4-10)15-11(13-8)5-9(2)14-15/h5-6,10H,3-4,7H2,1-2H3
InChIKeyNROMRGBMWLBBQT-UHFFFAOYSA-N
XLogP2.13
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine (CID 126954741) is 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine is Cc1cc(OCC2CC2)n2nc(C)cc2n1.
What is the InChIKey of 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is NROMRGBMWLBBQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-6-12(16-7-10-3-4-10)15-11(13-8)5-9(2)14-15/h5-6,10H,3-4,7H2,1-2H3.
What are the key properties of 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 217.27 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 126954741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).