7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine

C11H13FN4 — CID 146495670

IUPAC7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESF[C@@H]1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C11H13FN4/c12-9-2-1-7-15(8-9)11-4-5-13-10-3-6-14-16(10)11/h3-6,9H,1-2,7-8H2/t9-/m1/s1
InChIKeyJADIQBKMJWXJGP-SECBINFHSA-N
MW220.25 g/mol
LogP1.67
Rot. Bonds1

About 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine

7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine (PubChem CID 146495670) has the molecular formula C11H13FN4 and a molecular weight of 220.25 g/mol. Its IUPAC name is 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine
PubChem CID146495670
Molecular FormulaC11H13FN4
Molecular Weight220.25 g/mol
Exact Mass220.11
IUPAC Name7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESF[C@@H]1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C11H13FN4/c12-9-2-1-7-15(8-9)11-4-5-13-10-3-6-14-16(10)11/h3-6,9H,1-2,7-8H2/t9-/m1/s1
InChIKeyJADIQBKMJWXJGP-SECBINFHSA-N
XLogP1.67
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine (CID 146495670) is 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine is F[C@@H]1CCCN(c2ccnc3ccnn23)C1.
What is the InChIKey of 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is JADIQBKMJWXJGP-SECBINFHSA-N. The full InChI is InChI=1S/C11H13FN4/c12-9-2-1-7-15(8-9)11-4-5-13-10-3-6-14-16(10)11/h3-6,9H,1-2,7-8H2/t9-/m1/s1.
What are the key properties of 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine?
7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 220.25 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3R)-3-fluoropiperidin-1-yl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 146495670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).