N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide

C17H15N9O2 — CID 71799686

IUPACN-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide
SMILESCc1nccn1-c1ncc(NC(=O)COc2ccc(-n3cccn3)nn2)cn1
InChIInChI=1S/C17H15N9O2/c1-12-18-6-8-25(12)17-19-9-13(10-20-17)22-15(27)11-28-16-4-3-14(23-24-16)26-7-2-5-21-26/h2-10H,11H2,1H3,(H,22,27)
InChIKeyIBYVCMKOOKSBLP-UHFFFAOYSA-N
MW377.37 g/mol
LogP0.96
Rot. Bonds6

About N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide

N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide (PubChem CID 71799686) has the molecular formula C17H15N9O2 and a molecular weight of 377.37 g/mol. Its IUPAC name is N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide
PubChem CID71799686
Molecular FormulaC17H15N9O2
Molecular Weight377.37 g/mol
Exact Mass377.13
IUPAC NameN-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide
SMILESCc1nccn1-c1ncc(NC(=O)COc2ccc(-n3cccn3)nn2)cn1
InChIInChI=1S/C17H15N9O2/c1-12-18-6-8-25(12)17-19-9-13(10-20-17)22-15(27)11-28-16-4-3-14(23-24-16)26-7-2-5-21-26/h2-10H,11H2,1H3,(H,22,27)
InChIKeyIBYVCMKOOKSBLP-UHFFFAOYSA-N
XLogP0.96
TPSA125.53 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.37
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

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Related Compounds

2-(6-pyrazol-1-ylpyridazin-3-yl)oxy-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 71799683
2-(4-fluorophenoxy)-N-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]acetamide
CID 122306698
N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-4-phenylbutanamide
CID 121112648
N-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]-2-(2-methylphenoxy)acetamide
CID 122306694
N-(2-pyrazol-1-ylpyrimidin-5-yl)butanamide
CID 91967761
2-phenoxy-N-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]acetamide
CID 70702527
N-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]-4-phenylbutanamide
CID 122306542
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-2-naphthalen-2-yloxyacetamide
CID 90565021
2-cyclopentyl-N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]acetamide
CID 122301003
2-(4-methoxy-3-methylphenyl)-N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]acetamide
CID 122301081
N-[(2-piperidin-1-ylpyrimidin-4-yl)methyl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide
CID 91967334
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-3-propan-2-yloxypropanamide
CID 87018905

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide?
The IUPAC name of N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide (CID 71799686) is N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide.
What is the SMILES notation for N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide?
The canonical SMILES for N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide is Cc1nccn1-c1ncc(NC(=O)COc2ccc(-n3cccn3)nn2)cn1.
What is the InChIKey of N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide?
The InChIKey is IBYVCMKOOKSBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N9O2/c1-12-18-6-8-25(12)17-19-9-13(10-20-17)22-15(27)11-28-16-4-3-14(23-24-16)26-7-2-5-21-26/h2-10H,11H2,1H3,(H,22,27).
What are the key properties of N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide?
N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide has a molecular weight of 377.37 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide is sourced from PubChem (CID 71799686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).