N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide

C14H19N5O — CID 135217259

IUPACN-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCN(c2cc(C)nn3cc(C)nc23)C1
InChIInChI=1S/C14H19N5O/c1-9-6-13(14-15-10(2)7-19(14)17-9)18-5-4-12(8-18)16-11(3)20/h6-7,12H,4-5,8H2,1-3H3,(H,16,20)/t12-/m1/s1
InChIKeyFNKRNZLDVWZFAL-GFCCVEGCSA-N
MW273.34 g/mol
LogP1.06
Rot. Bonds2

About N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide

N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide (PubChem CID 135217259) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide
PubChem CID135217259
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CCN(c2cc(C)nn3cc(C)nc23)C1
InChIInChI=1S/C14H19N5O/c1-9-6-13(14-15-10(2)7-19(14)17-9)18-5-4-12(8-18)16-11(3)20/h6-7,12H,4-5,8H2,1-3H3,(H,16,20)/t12-/m1/s1
InChIKeyFNKRNZLDVWZFAL-GFCCVEGCSA-N
XLogP1.06
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide?
The IUPAC name of N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide (CID 135217259) is N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide is CC(=O)N[C@@H]1CCN(c2cc(C)nn3cc(C)nc23)C1.
What is the InChIKey of N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide?
The InChIKey is FNKRNZLDVWZFAL-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19N5O/c1-9-6-13(14-15-10(2)7-19(14)17-9)18-5-4-12(8-18)16-11(3)20/h6-7,12H,4-5,8H2,1-3H3,(H,16,20)/t12-/m1/s1.
What are the key properties of N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide?
N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide has a molecular weight of 273.34 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 135217259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).