2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine

C19H24N6 — CID 176942032

IUPAC2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
SMILESCCCc1ncccc1-c1c(C)nn2ccc(N3CCNCC3)nc12
InChIInChI=1S/C19H24N6/c1-3-5-16-15(6-4-8-21-16)18-14(2)23-25-11-7-17(22-19(18)25)24-12-9-20-10-13-24/h4,6-8,11,20H,3,5,9-10,12-13H2,1-2H3
InChIKeyMJNJRLSHGFSTLG-UHFFFAOYSA-N
MW336.44 g/mol
LogP2.46
Rot. Bonds4

About 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine

2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 176942032) has the molecular formula C19H24N6 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
PubChem CID176942032
Molecular FormulaC19H24N6
Molecular Weight336.44 g/mol
Exact Mass336.21
IUPAC Name2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
SMILESCCCc1ncccc1-c1c(C)nn2ccc(N3CCNCC3)nc12
InChIInChI=1S/C19H24N6/c1-3-5-16-15(6-4-8-21-16)18-14(2)23-25-11-7-17(22-19(18)25)24-12-9-20-10-13-24/h4,6-8,11,20H,3,5,9-10,12-13H2,1-2H3
InChIKeyMJNJRLSHGFSTLG-UHFFFAOYSA-N
XLogP2.46
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methylcyclopropane;5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
CID 176941825
6-methoxy-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
CID 176942090
3-(5-methoxy-2-propyl-3-pyridinyl)-5-piperazin-1-ylpyrazolo[1,5-a]pyrimidine;methylcyclopropane
CID 176941983
3-(2-ethoxy-3-pyridinyl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 162634684
1-(5-propyl-2-pyridinyl)piperazine
CID 152988088
butane;2-piperazin-1-ylpyrimidine
CID 144912345
5-(2-piperazin-1-yl-4-pyridinyl)-3-propyl-1,2,4-oxadiazole
CID 56686520
1-[2-(2-phenylethyl)-3-pyridinyl]piperazine
CID 173128049
1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride
CID 70057644
ethane;2-methyl-4-piperazin-1-ylpyrimidine
CID 144746590
heptane;2-piperazin-1-ylpyrimidine
CID 144585904
5-piperazin-1-yl-3-propyl-1,2,4-triazine
CID 116823993

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine (CID 176942032) is 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine is CCCc1ncccc1-c1c(C)nn2ccc(N3CCNCC3)nc12.
What is the InChIKey of 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is MJNJRLSHGFSTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6/c1-3-5-16-15(6-4-8-21-16)18-14(2)23-25-11-7-17(22-19(18)25)24-12-9-20-10-13-24/h4,6-8,11,20H,3,5,9-10,12-13H2,1-2H3.
What are the key properties of 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine?
2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 336.44 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperazin-1-yl-3-(2-propyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 176942032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).