N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine

C15H14N6 — CID 10192938

IUPACN-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
SMILESC=Cc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1
InChIInChI=1S/C15H14N6/c1-2-10-5-6-14-12(9-17-21(14)20-10)13-7-8-16-15(19-13)18-11-3-4-11/h2,5-9,11H,1,3-4H2,(H,16,18,19)
InChIKeyRNTPQNNOOQMIBD-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.40
Rot. Bonds4

About N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine

N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine (PubChem CID 10192938) has the molecular formula C15H14N6 and a molecular weight of 278.32 g/mol. Its IUPAC name is N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
PubChem CID10192938
Molecular FormulaC15H14N6
Molecular Weight278.32 g/mol
Exact Mass278.13
IUPAC NameN-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
SMILESC=Cc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1
InChIInChI=1S/C15H14N6/c1-2-10-5-6-14-12(9-17-21(14)20-10)13-7-8-16-15(19-13)18-11-3-4-11/h2,5-9,11H,1,3-4H2,(H,16,18,19)
InChIKeyRNTPQNNOOQMIBD-UHFFFAOYSA-N
XLogP2.40
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The IUPAC name of N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine (CID 10192938) is N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine.
What is the SMILES notation for N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The canonical SMILES for N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine is C=Cc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1.
What is the InChIKey of N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The InChIKey is RNTPQNNOOQMIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6/c1-2-10-5-6-14-12(9-17-21(14)20-10)13-7-8-16-15(19-13)18-11-3-4-11/h2,5-9,11H,1,3-4H2,(H,16,18,19).
What are the key properties of N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine has a molecular weight of 278.32 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(6-ethenylpyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine is sourced from PubChem (CID 10192938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).