5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine

C15H19N7 — CID 90103911

IUPAC5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine
SMILESCC(C)Cn1cc(Nc2nc(C3CC3)nc3cn[nH]c23)cn1
InChIInChI=1S/C15H19N7/c1-9(2)7-22-8-11(5-17-22)18-15-13-12(6-16-21-13)19-14(20-15)10-3-4-10/h5-6,8-10H,3-4,7H2,1-2H3,(H,16,21)(H,18,19,20)
InChIKeyPCMJJRRXHUAGRW-UHFFFAOYSA-N
MW297.37 g/mol
LogP2.83
Rot. Bonds5

About 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine

5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine (PubChem CID 90103911) has the molecular formula C15H19N7 and a molecular weight of 297.37 g/mol. Its IUPAC name is 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine
PubChem CID90103911
Molecular FormulaC15H19N7
Molecular Weight297.37 g/mol
Exact Mass297.17
IUPAC Name5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine
SMILESCC(C)Cn1cc(Nc2nc(C3CC3)nc3cn[nH]c23)cn1
InChIInChI=1S/C15H19N7/c1-9(2)7-22-8-11(5-17-22)18-15-13-12(6-16-21-13)19-14(20-15)10-3-4-10/h5-6,8-10H,3-4,7H2,1-2H3,(H,16,21)(H,18,19,20)
InChIKeyPCMJJRRXHUAGRW-UHFFFAOYSA-N
XLogP2.83
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine?
The IUPAC name of 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine (CID 90103911) is 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine.
What is the SMILES notation for 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine?
The canonical SMILES for 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine is CC(C)Cn1cc(Nc2nc(C3CC3)nc3cn[nH]c23)cn1.
What is the InChIKey of 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine?
The InChIKey is PCMJJRRXHUAGRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7/c1-9(2)7-22-8-11(5-17-22)18-15-13-12(6-16-21-13)19-14(20-15)10-3-4-10/h5-6,8-10H,3-4,7H2,1-2H3,(H,16,21)(H,18,19,20).
What are the key properties of 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine?
5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine has a molecular weight of 297.37 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[1-(2-methylpropyl)pyrazol-4-yl]-1H-pyrazolo[4,5-d]pyrimidin-7-amine is sourced from PubChem (CID 90103911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).