1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine

C15H24N6 — CID 79703221

IUPAC1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC(C)N(CC1CCNCC1)c1ncnc2c1cnn2C
InChIInChI=1S/C15H24N6/c1-11(2)21(9-12-4-6-16-7-5-12)15-13-8-19-20(3)14(13)17-10-18-15/h8,10-12,16H,4-7,9H2,1-3H3
InChIKeyZSRBVAPKZKKYFA-UHFFFAOYSA-N
MW288.40 g/mol
LogP1.58
Rot. Bonds4

About 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine

1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 79703221) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID79703221
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCC(C)N(CC1CCNCC1)c1ncnc2c1cnn2C
InChIInChI=1S/C15H24N6/c1-11(2)21(9-12-4-6-16-7-5-12)15-13-8-19-20(3)14(13)17-10-18-15/h8,10-12,16H,4-7,9H2,1-3H3
InChIKeyZSRBVAPKZKKYFA-UHFFFAOYSA-N
XLogP1.58
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine (CID 79703221) is 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine is CC(C)N(CC1CCNCC1)c1ncnc2c1cnn2C.
What is the InChIKey of 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is ZSRBVAPKZKKYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-11(2)21(9-12-4-6-16-7-5-12)15-13-8-19-20(3)14(13)17-10-18-15/h8,10-12,16H,4-7,9H2,1-3H3.
What are the key properties of 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine?
1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 288.40 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 79703221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).