3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C11H14N4O — CID 117103174

IUPAC3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1ccnc2c(CC3CCOC3)cnn12
InChIInChI=1S/C11H14N4O/c12-10-1-3-13-11-9(6-14-15(10)11)5-8-2-4-16-7-8/h1,3,6,8H,2,4-5,7,12H2
InChIKeyFALWKSLTXLBZDZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.89
Rot. Bonds2

About 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 117103174) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID117103174
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1ccnc2c(CC3CCOC3)cnn12
InChIInChI=1S/C11H14N4O/c12-10-1-3-13-11-9(6-14-15(10)11)5-8-2-4-16-7-8/h1,3,6,8H,2,4-5,7,12H2
InChIKeyFALWKSLTXLBZDZ-UHFFFAOYSA-N
XLogP0.89
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Pyrazolo[1,5-a]pyrimidine-6-propanol, 6-acetate
CID 12773582
3-{Pyrazolo[1,5-a]pyrimidin-6-yl}propan-1-ol
CID 12773578
5-propyl-N-[3-(tetrahydro-3-furanyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56888664
5-ethyl-N-[3-(tetrahydrofuran-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70782443
3-(Oxan-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 105524899
3,3-Difluoro-3-{pyrazolo[1,5-a]pyrimidin-6-yl}propan-1-ol
CID 165632870
3-Fluoro-3-{pyrazolo[1,5-a]pyrimidin-6-yl}propan-1-amine
CID 165849177
5-(Oxolan-3-ylmethyl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-amine
CID 68588507
5-(Oxan-4-ylmethyl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-amine
CID 68590968
2-[2-(4-Aminopyrazolo[1,5-a][1,3,5]triazin-8-yl)ethyl]propane-1,3-diol
CID 68941044
5-(Tetrahydro-pyran-4-yl)-pyrazolo[1,5-a]pyrimidin-7-ylamine
CID 83705758
3-Piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 117103191

Frequently Asked Questions

What is the IUPAC name of 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 117103174) is 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is Nc1ccnc2c(CC3CCOC3)cnn12.
What is the InChIKey of 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is FALWKSLTXLBZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c12-10-1-3-13-11-9(6-14-15(10)11)5-8-2-4-16-7-8/h1,3,6,8H,2,4-5,7,12H2.
What are the key properties of 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 218.26 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 117103174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).