7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine

C15H19ClN4 — CID 121397010

IUPAC7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1c(C2CC2)nc2cc(C3CCCCN3)nn2c1Cl
InChIInChI=1S/C15H19ClN4/c1-9-14(10-5-6-10)18-13-8-12(19-20(13)15(9)16)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3
InChIKeyGREMGGOVBUVASQ-UHFFFAOYSA-N
MW290.80 g/mol
LogP3.38
Rot. Bonds2

About 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine

7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 121397010) has the molecular formula C15H19ClN4 and a molecular weight of 290.80 g/mol. Its IUPAC name is 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID121397010
Molecular FormulaC15H19ClN4
Molecular Weight290.80 g/mol
Exact Mass290.13
IUPAC Name7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1c(C2CC2)nc2cc(C3CCCCN3)nn2c1Cl
InChIInChI=1S/C15H19ClN4/c1-9-14(10-5-6-10)18-13-8-12(19-20(13)15(9)16)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3
InChIKeyGREMGGOVBUVASQ-UHFFFAOYSA-N
XLogP3.38
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.80
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine (CID 121397010) is 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine is Cc1c(C2CC2)nc2cc(C3CCCCN3)nn2c1Cl.
What is the InChIKey of 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is GREMGGOVBUVASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4/c1-9-14(10-5-6-10)18-13-8-12(19-20(13)15(9)16)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3.
What are the key properties of 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 290.80 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 121397010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).