6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine

C10H13N5 — CID 175246786

IUPAC6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2nc(C3CC3)nc(N)c12
InChIInChI=1S/C10H13N5/c1-5-7-8(11)12-9(6-3-4-6)13-10(7)15(2)14-5/h6H,3-4H2,1-2H3,(H2,11,12,13)
InChIKeyMWSHPFBAPVCMMC-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.13
Rot. Bonds1

About 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine

6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 175246786) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID175246786
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2nc(C3CC3)nc(N)c12
InChIInChI=1S/C10H13N5/c1-5-7-8(11)12-9(6-3-4-6)13-10(7)15(2)14-5/h6H,3-4H2,1-2H3,(H2,11,12,13)
InChIKeyMWSHPFBAPVCMMC-UHFFFAOYSA-N
XLogP1.13
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine (CID 175246786) is 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine is Cc1nn(C)c2nc(C3CC3)nc(N)c12.
What is the InChIKey of 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is MWSHPFBAPVCMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-5-7-8(11)12-9(6-3-4-6)13-10(7)15(2)14-5/h6H,3-4H2,1-2H3,(H2,11,12,13).
What are the key properties of 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 203.25 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 175246786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).