4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine

C9H10N4 — CID 166783555

IUPAC4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine
SMILESCn1ncc2c(C3CC3)ncnc21
InChIInChI=1S/C9H10N4/c1-13-9-7(4-12-13)8(6-2-3-6)10-5-11-9/h4-6H,2-3H2,1H3
InChIKeySRYWDPZPIAJLHA-UHFFFAOYSA-N
MW174.21 g/mol
LogP1.24
Rot. Bonds1

About 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine

4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine (PubChem CID 166783555) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine.

Molecular Properties

Compound Name4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine
PubChem CID166783555
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine
SMILESCn1ncc2c(C3CC3)ncnc21
InChIInChI=1S/C9H10N4/c1-13-9-7(4-12-13)8(6-2-3-6)10-5-11-9/h4-6H,2-3H2,1H3
InChIKeySRYWDPZPIAJLHA-UHFFFAOYSA-N
XLogP1.24
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine?
The IUPAC name of 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine (CID 166783555) is 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine.
What is the SMILES notation for 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine?
The canonical SMILES for 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine is Cn1ncc2c(C3CC3)ncnc21.
What is the InChIKey of 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine?
The InChIKey is SRYWDPZPIAJLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-13-9-7(4-12-13)8(6-2-3-6)10-5-11-9/h4-6H,2-3H2,1H3.
What are the key properties of 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine?
4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine has a molecular weight of 174.21 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine is sourced from PubChem (CID 166783555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).