1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide

C14H20N4O3 — CID 78784806

IUPAC1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide
SMILESCCCn1nc(C(=O)N2CCCC(C(N)=O)C2)ccc1=O
InChIInChI=1S/C14H20N4O3/c1-2-7-18-12(19)6-5-11(16-18)14(21)17-8-3-4-10(9-17)13(15)20/h5-6,10H,2-4,7-9H2,1H3,(H2,15,20)
InChIKeyNYOVJFWLYINKAE-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.01
Rot. Bonds4

About 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide

1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide (PubChem CID 78784806) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide
PubChem CID78784806
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide
SMILESCCCn1nc(C(=O)N2CCCC(C(N)=O)C2)ccc1=O
InChIInChI=1S/C14H20N4O3/c1-2-7-18-12(19)6-5-11(16-18)14(21)17-8-3-4-10(9-17)13(15)20/h5-6,10H,2-4,7-9H2,1H3,(H2,15,20)
InChIKeyNYOVJFWLYINKAE-UHFFFAOYSA-N
XLogP-0.01
TPSA98.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 1-(1-ethyl-6-oxopyridazine-3-carbonyl)piperidine-3-carboxylate
CID 121066862
6-(3-hydroxyazetidine-1-carbonyl)-2-propylpyridazin-3-one
CID 63106592
2-butyl-6-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)piperidine-1-carbonyl]pyridazin-3-one
CID 55556880
2-(2-methoxyethyl)-6-[(3S)-3-methylpiperidine-1-carbonyl]pyridazin-3-one
CID 94179531
6-(4-benzoylpiperidine-1-carbonyl)-2-propylpyridazin-3-one
CID 18143303
2-[1-(6-oxo-1-propylpyridazine-3-carbonyl)azetidin-3-yl]acetic acid
CID 64603756
1-[5-(aminomethyl)pyridine-2-carbonyl]piperidine-3-carboxamide
CID 63724885
6-[2-(2-hydroxypropan-2-yl)pyrrolidine-1-carbonyl]-2-propylpyridazin-3-one
CID 75431167
6-[(3S)-3-ethyl-4-(2-methoxyethyl)piperazine-1-carbonyl]-2-propylpyridazin-3-one
CID 97028133
N-cyclooctyl-6-oxo-1-propylpyridazine-3-carboxamide
CID 39724166
6-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]-2-propylpyridazin-3-one
CID 55466009
N-[1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidin-4-yl]benzenesulfonamide
CID 33161659

Frequently Asked Questions

What is the IUPAC name of 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide (CID 78784806) is 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide is CCCn1nc(C(=O)N2CCCC(C(N)=O)C2)ccc1=O.
What is the InChIKey of 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is NYOVJFWLYINKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-2-7-18-12(19)6-5-11(16-18)14(21)17-8-3-4-10(9-17)13(15)20/h5-6,10H,2-4,7-9H2,1H3,(H2,15,20).
What are the key properties of 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide?
1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of -0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 78784806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).