6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide

C18H14N8O2 — CID 146407970

IUPAC6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CC5)n4)nc4occn34)nn12
InChIInChI=1S/C18H14N8O2/c19-17(27)13-9-20-14-4-3-12(23-26(13)14)16-15(21-18-24(16)7-8-28-18)11-5-6-25(22-11)10-1-2-10/h3-10H,1-2H2,(H2,19,27)
InChIKeyKEUPTSJACSUKEX-UHFFFAOYSA-N
MW374.36 g/mol
LogP1.93
Rot. Bonds4

About 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide

6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 146407970) has the molecular formula C18H14N8O2 and a molecular weight of 374.36 g/mol. Its IUPAC name is 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID146407970
Molecular FormulaC18H14N8O2
Molecular Weight374.36 g/mol
Exact Mass374.12
IUPAC Name6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CC5)n4)nc4occn34)nn12
InChIInChI=1S/C18H14N8O2/c19-17(27)13-9-20-14-4-3-12(23-26(13)14)16-15(21-18-24(16)7-8-28-18)11-5-6-25(22-11)10-1-2-10/h3-10H,1-2H2,(H2,19,27)
InChIKeyKEUPTSJACSUKEX-UHFFFAOYSA-N
XLogP1.93
TPSA121.54 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.36
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide (CID 146407970) is 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide is NC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CC5)n4)nc4occn34)nn12.
What is the InChIKey of 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is KEUPTSJACSUKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N8O2/c19-17(27)13-9-20-14-4-3-12(23-26(13)14)16-15(21-18-24(16)7-8-28-18)11-5-6-25(22-11)10-1-2-10/h3-10H,1-2H2,(H2,19,27).
What are the key properties of 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide?
6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 374.36 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(1-cyclopropylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 146407970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).