N-pyridazin-3-ylazetidine-3-carboxamide

C8H10N4O — CID 90012152

IUPACN-pyridazin-3-ylazetidine-3-carboxamide
SMILESO=C(Nc1cccnn1)C1CNC1
InChIInChI=1S/C8H10N4O/c13-8(6-4-9-5-6)11-7-2-1-3-10-12-7/h1-3,6,9H,4-5H2,(H,11,12,13)
InChIKeyKGEXKCMGYQQMLW-UHFFFAOYSA-N
MW178.20 g/mol
LogP-0.37
Rot. Bonds2

About N-pyridazin-3-ylazetidine-3-carboxamide

N-pyridazin-3-ylazetidine-3-carboxamide (PubChem CID 90012152) has the molecular formula C8H10N4O and a molecular weight of 178.20 g/mol. Its IUPAC name is N-pyridazin-3-ylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-pyridazin-3-ylazetidine-3-carboxamide
PubChem CID90012152
Molecular FormulaC8H10N4O
Molecular Weight178.20 g/mol
Exact Mass178.09
IUPAC NameN-pyridazin-3-ylazetidine-3-carboxamide
SMILESO=C(Nc1cccnn1)C1CNC1
InChIInChI=1S/C8H10N4O/c13-8(6-4-9-5-6)11-7-2-1-3-10-12-7/h1-3,6,9H,4-5H2,(H,11,12,13)
InChIKeyKGEXKCMGYQQMLW-UHFFFAOYSA-N
XLogP-0.37
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.20
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-[3-oxo-3-[4-(pyridazin-3-ylamino)piperidin-1-yl]propyl]propanamide
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CID 21858219
Pyridazine-3-t-butylcarboxamide
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1-(6-Fluoropyridazin-3-yl)azetidine-3-carboxamide
CID 141392253
1-(4-Pyridazin-3-yl-1,4-diazepan-1-yl)-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 56780006
N-pyridazin-3-yl-2-(2,2,2-trifluoroethylamino)acetamide
CID 116786691
2-amino-3,3,3-trifluoro-2-methyl-N-pyridazin-3-ylpropanamide
CID 116786693
N-pyridazin-3-yl-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 116786761
N-pyridazin-3-ylpropanamide
CID 17995453
3-(3-Aminopropylamino)pyridazine
CID 18694207
N-[2-(3-Pyridazinylamino)ethyl]acetamide
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N-3-Pyridazinylacetamide
CID 53944100

Frequently Asked Questions

What is the IUPAC name of N-pyridazin-3-ylazetidine-3-carboxamide?
The IUPAC name of N-pyridazin-3-ylazetidine-3-carboxamide (CID 90012152) is N-pyridazin-3-ylazetidine-3-carboxamide.
What is the SMILES notation for N-pyridazin-3-ylazetidine-3-carboxamide?
The canonical SMILES for N-pyridazin-3-ylazetidine-3-carboxamide is O=C(Nc1cccnn1)C1CNC1.
What is the InChIKey of N-pyridazin-3-ylazetidine-3-carboxamide?
The InChIKey is KGEXKCMGYQQMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c13-8(6-4-9-5-6)11-7-2-1-3-10-12-7/h1-3,6,9H,4-5H2,(H,11,12,13).
What are the key properties of N-pyridazin-3-ylazetidine-3-carboxamide?
N-pyridazin-3-ylazetidine-3-carboxamide has a molecular weight of 178.20 g/mol, XLogP of -0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridazin-3-ylazetidine-3-carboxamide is sourced from PubChem (CID 90012152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).