4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine

C15H24N6 — CID 56890443

IUPAC4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine
SMILESCCN1CCN(c2nc(C(C)C)nc3c2cnn3C)CC1
InChIInChI=1S/C15H24N6/c1-5-20-6-8-21(9-7-20)15-12-10-16-19(4)14(12)17-13(18-15)11(2)3/h10-11H,5-9H2,1-4H3
InChIKeySKRDJIZPAYASKI-UHFFFAOYSA-N
MW288.40 g/mol
LogP1.63
Rot. Bonds3

About 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine

4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine (PubChem CID 56890443) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine
PubChem CID56890443
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine
SMILESCCN1CCN(c2nc(C(C)C)nc3c2cnn3C)CC1
InChIInChI=1S/C15H24N6/c1-5-20-6-8-21(9-7-20)15-12-10-16-19(4)14(12)17-13(18-15)11(2)3/h10-11H,5-9H2,1-4H3
InChIKeySKRDJIZPAYASKI-UHFFFAOYSA-N
XLogP1.63
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(4-ethylpiperazin-1-yl)-1,6-dimethylpyrazolo[5,4-d]pyrimidine
CID 47292239
4-[6-(4-ethylpiperazin-1-yl)-1-methylpyrazolo[5,4-d]pyrimidin-4-yl]morpholine
CID 53039070
2-[4-[4-(4-ethylpiperazin-1-yl)-1-methylpyrazolo[5,4-d]pyrimidin-6-yl]piperazin-1-yl]ethanol;hydrochloride
CID 146059668
4-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine
CID 95708844
9-(1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)-3,9-diazaspiro[5.6]dodecane
CID 56911277
(9aR)-2-(1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 95720333
6-(4-benzylpiperazin-1-yl)-4-(4-ethylpiperazin-1-yl)-1-methylpyrazolo[5,4-d]pyrimidine;hydrochloride
CID 146059672
1-methyl-6-(4-propylpiperazin-1-yl)-4-pyrrolidin-1-ylpyrazolo[5,4-d]pyrimidine
CID 50795404
1,6-dimethyl-4-(4-propan-2-ylpiperazin-1-yl)pyrazolo[5,4-d]pyrimidine
CID 47292699
N-[[(2R)-8-(1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]acetamide
CID 95724463
1-methyl-4-(4-methylpiperazin-1-yl)pyrazolo[5,4-d]pyrimidin-6-amine
CID 71004312
N-ethyl-1-methyl-4-pyrrolidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
CID 50795389

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine?
The IUPAC name of 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine (CID 56890443) is 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine.
What is the SMILES notation for 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine?
The canonical SMILES for 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine is CCN1CCN(c2nc(C(C)C)nc3c2cnn3C)CC1.
What is the InChIKey of 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine?
The InChIKey is SKRDJIZPAYASKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-5-20-6-8-21(9-7-20)15-12-10-16-19(4)14(12)17-13(18-15)11(2)3/h10-11H,5-9H2,1-4H3.
What are the key properties of 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine?
4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine has a molecular weight of 288.40 g/mol, XLogP of 1.63, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperazin-1-yl)-1-methyl-6-propan-2-ylpyrazolo[5,4-d]pyrimidine is sourced from PubChem (CID 56890443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).