N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine

C11H15N5 — CID 39893204

IUPACN-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine
SMILESCc1nc(NC2CC2)c2c(n1)c(C)nn2C
InChIInChI=1S/C11H15N5/c1-6-9-10(16(3)15-6)11(13-7(2)12-9)14-8-4-5-8/h8H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyMNLQIALHVIONJB-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.55
Rot. Bonds2

About N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine

N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine (PubChem CID 39893204) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine.

Molecular Properties

Compound NameN-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine
PubChem CID39893204
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine
SMILESCc1nc(NC2CC2)c2c(n1)c(C)nn2C
InChIInChI=1S/C11H15N5/c1-6-9-10(16(3)15-6)11(13-7(2)12-9)14-8-4-5-8/h8H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyMNLQIALHVIONJB-UHFFFAOYSA-N
XLogP1.55
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine?
The IUPAC name of N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine (CID 39893204) is N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine.
What is the SMILES notation for N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine?
The canonical SMILES for N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine is Cc1nc(NC2CC2)c2c(n1)c(C)nn2C.
What is the InChIKey of N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine?
The InChIKey is MNLQIALHVIONJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-6-9-10(16(3)15-6)11(13-7(2)12-9)14-8-4-5-8/h8H,4-5H2,1-3H3,(H,12,13,14).
What are the key properties of N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine?
N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine has a molecular weight of 217.28 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,3,5-trimethylpyrazolo[4,5-d]pyrimidin-7-amine is sourced from PubChem (CID 39893204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).