N-pyridazin-4-ylcyclopropanecarboxamide

C8H9N3O — CID 90198515

IUPACN-pyridazin-4-ylcyclopropanecarboxamide
SMILESO=C(Nc1ccnnc1)C1CC1
InChIInChI=1S/C8H9N3O/c12-8(6-1-2-6)11-7-3-4-9-10-5-7/h3-6H,1-2H2,(H,9,11,12)
InChIKeyRUBBXVYEDNTILV-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.83
Rot. Bonds2

About N-pyridazin-4-ylcyclopropanecarboxamide

N-pyridazin-4-ylcyclopropanecarboxamide (PubChem CID 90198515) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is N-pyridazin-4-ylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-pyridazin-4-ylcyclopropanecarboxamide
PubChem CID90198515
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC NameN-pyridazin-4-ylcyclopropanecarboxamide
SMILESO=C(Nc1ccnnc1)C1CC1
InChIInChI=1S/C8H9N3O/c12-8(6-1-2-6)11-7-3-4-9-10-5-7/h3-6H,1-2H2,(H,9,11,12)
InChIKeyRUBBXVYEDNTILV-UHFFFAOYSA-N
XLogP0.83
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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4-fluoro-2,5-dimethyl-N-pyridazin-4-yl-3H-pyrazole-4-carboxamide
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4-(aminomethyl)-N-pyridazin-4-ylcyclohexane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-pyridazin-4-ylcyclopropanecarboxamide?
The IUPAC name of N-pyridazin-4-ylcyclopropanecarboxamide (CID 90198515) is N-pyridazin-4-ylcyclopropanecarboxamide.
What is the SMILES notation for N-pyridazin-4-ylcyclopropanecarboxamide?
The canonical SMILES for N-pyridazin-4-ylcyclopropanecarboxamide is O=C(Nc1ccnnc1)C1CC1.
What is the InChIKey of N-pyridazin-4-ylcyclopropanecarboxamide?
The InChIKey is RUBBXVYEDNTILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c12-8(6-1-2-6)11-7-3-4-9-10-5-7/h3-6H,1-2H2,(H,9,11,12).
What are the key properties of N-pyridazin-4-ylcyclopropanecarboxamide?
N-pyridazin-4-ylcyclopropanecarboxamide has a molecular weight of 163.18 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridazin-4-ylcyclopropanecarboxamide is sourced from PubChem (CID 90198515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).