3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine

C19H25N7 — CID 50966965

IUPAC3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine
SMILESCCCc1nc(C)cc(N2CCN(Cc3cnn4cccnc34)CC2)n1
InChIInChI=1S/C19H25N7/c1-3-5-17-22-15(2)12-18(23-17)25-10-8-24(9-11-25)14-16-13-21-26-7-4-6-20-19(16)26/h4,6-7,12-13H,3,5,8-11,14H2,1-2H3
InChIKeyMPQBTULACOKEOP-UHFFFAOYSA-N
MW351.46 g/mol
LogP2.10
Rot. Bonds5

About 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine

3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine (PubChem CID 50966965) has the molecular formula C19H25N7 and a molecular weight of 351.46 g/mol. Its IUPAC name is 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine
PubChem CID50966965
Molecular FormulaC19H25N7
Molecular Weight351.46 g/mol
Exact Mass351.22
IUPAC Name3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine
SMILESCCCc1nc(C)cc(N2CCN(Cc3cnn4cccnc34)CC2)n1
InChIInChI=1S/C19H25N7/c1-3-5-17-22-15(2)12-18(23-17)25-10-8-24(9-11-25)14-16-13-21-26-7-4-6-20-19(16)26/h4,6-7,12-13H,3,5,8-11,14H2,1-2H3
InChIKeyMPQBTULACOKEOP-UHFFFAOYSA-N
XLogP2.10
TPSA62.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.46
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine with MolForge

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Related Compounds

7-(6-methyl-2-propylpyrimidin-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 56892294
N-methyl-1-(6-methyl-2-propylpyrimidin-4-yl)-N-(3-pyrazol-1-ylpropyl)piperidin-4-amine
CID 72881693
4-methyl-2-propyl-6-[4-(4-pyrazin-2-ylpiperazin-1-yl)piperidin-1-yl]pyrimidine
CID 72927568
8-[[4-(2,6-dimethylpyrimidin-4-yl)piperazin-1-yl]methyl]-6-fluoroquinoline
CID 86868224
3-propyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 134386294
4-methyl-2-methylsulfanyl-6-[4-[[2-(trifluoromethyl)-3-pyridinyl]methyl]piperazin-1-yl]pyrimidine
CID 171337761
N-ethyl-2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 80940402
formic acid;5-methyl-3-[[4-[1-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)piperidin-4-yl]piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 171321762
2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 80945393
N-ethyl-4-methyl-6-[4-[(5-methyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]pyrimidin-2-amine
CID 154583151
4-methyl-6-[(3R)-3-methylpiperidin-1-yl]-2-propylpyrimidine
CID 40640900
4-methyl-6-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-1-yl]pyrimidin-2-amine
CID 50979339

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine (CID 50966965) is 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine is CCCc1nc(C)cc(N2CCN(Cc3cnn4cccnc34)CC2)n1.
What is the InChIKey of 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is MPQBTULACOKEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7/c1-3-5-17-22-15(2)12-18(23-17)25-10-8-24(9-11-25)14-16-13-21-26-7-4-6-20-19(16)26/h4,6-7,12-13H,3,5,8-11,14H2,1-2H3.
What are the key properties of 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine?
3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 351.46 g/mol, XLogP of 2.10, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(6-methyl-2-propylpyrimidin-4-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 50966965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).