N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide

C11H15N3O2 — CID 945292

IUPACN-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C11H15N3O2/c15-10-7-6-9(13-14-10)11(16)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,16)(H,14,15)
InChIKeyPHUOWUVVYBRFCB-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.83
Rot. Bonds2

About N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide

N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 945292) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID945292
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C11H15N3O2/c15-10-7-6-9(13-14-10)11(16)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,16)(H,14,15)
InChIKeyPHUOWUVVYBRFCB-UHFFFAOYSA-N
XLogP0.83
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 2574206
N-cycloheptyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 940468
3-(2-methylpiperidine-1-carbonyl)-1H-pyridazin-6-one
CID 4369642
N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide
CID 2541694
N-isopropyl-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 42443181
N-cyclohexyl-N,1-dimethyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 42443192
N-cyclopentyl-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 9168301
N-((1r,4r)-4-aminocyclohexyl)-6-hydroxypyridazine-3-carboxamide
CID 103806098
N-((1r,4r)-4-(3-aminopropanamido)cyclohexyl)-6-hydroxypyridazine-3-carboxamide
CID 132228019
6-oxo-N-(3,3,3-trifluoropropyl)-1H-pyridazine-3-carboxamide
CID 103709585
6-oxo-N-(4,4,4-trifluorobutyl)-1H-pyridazine-3-carboxamide
CID 103713365
6-oxo-N-(4,4,4-trifluorobutan-2-yl)-1H-pyridazine-3-carboxamide
CID 104854846

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide (CID 945292) is N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide is O=C(NC1CCCCC1)c1ccc(=O)[nH]n1.
What is the InChIKey of N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is PHUOWUVVYBRFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-10-7-6-9(13-14-10)11(16)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,16)(H,14,15).
What are the key properties of N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide?
N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 945292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).