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

C16H18N6O — CID 10286399

IUPACN-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
SMILESCC(C)Oc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1
InChIInChI=1S/C16H18N6O/c1-10(2)23-15-6-5-14-12(9-18-22(14)21-15)13-7-8-17-16(20-13)19-11-3-4-11/h5-11H,3-4H2,1-2H3,(H,17,19,20)
InChIKeyMFBCYZQBHGCRST-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.55
Rot. Bonds5

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

N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine (PubChem CID 10286399) has the molecular formula C16H18N6O and a molecular weight of 310.36 g/mol. Its IUPAC name is N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
PubChem CID10286399
Molecular FormulaC16H18N6O
Molecular Weight310.36 g/mol
Exact Mass310.15
IUPAC NameN-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
SMILESCC(C)Oc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1
InChIInChI=1S/C16H18N6O/c1-10(2)23-15-6-5-14-12(9-18-22(14)21-15)13-7-8-17-16(20-13)19-11-3-4-11/h5-11H,3-4H2,1-2H3,(H,17,19,20)
InChIKeyMFBCYZQBHGCRST-UHFFFAOYSA-N
XLogP2.55
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The IUPAC name of N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine (CID 10286399) is N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine.
What is the SMILES notation for N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The canonical SMILES for N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine is CC(C)Oc1ccc2c(-c3ccnc(NC4CC4)n3)cnn2n1.
What is the InChIKey of N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
The InChIKey is MFBCYZQBHGCRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O/c1-10(2)23-15-6-5-14-12(9-18-22(14)21-15)13-7-8-17-16(20-13)19-11-3-4-11/h5-11H,3-4H2,1-2H3,(H,17,19,20).
What are the key properties of N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine?
N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine has a molecular weight of 310.36 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(6-propan-2-yloxypyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine is sourced from PubChem (CID 10286399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).