7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

C15H18N4O — CID 136838222

IUPAC7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESc1cncc(-c2cc3n(n2)C(C2CCOC2)CCN3)c1
InChIInChI=1S/C15H18N4O/c1-2-11(9-16-5-1)13-8-15-17-6-3-14(19(15)18-13)12-4-7-20-10-12/h1-2,5,8-9,12,14,17H,3-4,6-7,10H2
InChIKeyYDXLMJCXONBDQN-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.34
Rot. Bonds2

About 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (PubChem CID 136838222) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
PubChem CID136838222
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESc1cncc(-c2cc3n(n2)C(C2CCOC2)CCN3)c1
InChIInChI=1S/C15H18N4O/c1-2-11(9-16-5-1)13-8-15-17-6-3-14(19(15)18-13)12-4-7-20-10-12/h1-2,5,8-9,12,14,17H,3-4,6-7,10H2
InChIKeyYDXLMJCXONBDQN-UHFFFAOYSA-N
XLogP2.34
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (CID 136838222) is 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is c1cncc(-c2cc3n(n2)C(C2CCOC2)CCN3)c1.
What is the InChIKey of 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The InChIKey is YDXLMJCXONBDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-2-11(9-16-5-1)13-8-15-17-6-3-14(19(15)18-13)12-4-7-20-10-12/h1-2,5,8-9,12,14,17H,3-4,6-7,10H2.
What are the key properties of 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine has a molecular weight of 270.34 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(oxolan-3-yl)-2-pyridin-3-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 136838222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).