1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide

C11H16N4O3 — CID 43397906

IUPAC1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)C2=NNC(=O)CC2)C1
InChIInChI=1S/C11H16N4O3/c12-10(17)7-2-1-5-15(6-7)11(18)8-3-4-9(16)14-13-8/h7H,1-6H2,(H2,12,17)(H,14,16)
InChIKeyDQKVLIPGRPETCH-UHFFFAOYSA-N
MW252.27 g/mol
LogP-1.02
Rot. Bonds2

About 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide

1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide (PubChem CID 43397906) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide
PubChem CID43397906
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)C2=NNC(=O)CC2)C1
InChIInChI=1S/C11H16N4O3/c12-10(17)7-2-1-5-15(6-7)11(18)8-3-4-9(16)14-13-8/h7H,1-6H2,(H2,12,17)(H,14,16)
InChIKeyDQKVLIPGRPETCH-UHFFFAOYSA-N
XLogP-1.02
TPSA104.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(pyrrolidine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 43397830
3-[3-(trifluoromethyl)piperidine-1-carbonyl]-4,5-dihydro-1H-pyridazin-6-one
CID 60655820
6-oxo-3-[3-[(sulfamoylamino)methyl]piperidine-1-carbonyl]-4,5-dihydro-1H-pyridazine
CID 60959166
3-(3-hydroxyazetidine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 63106781
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
3-(4-butanoyl-1,4-diazepane-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 110805956
(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 28826297
3-(4-tert-butylpiperazine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 61245068
1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
CID 103891600
1-(4-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 103336874
1-(2-bromobenzoyl)piperidine-3-carboxamide
CID 24692766
2-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxylic acid
CID 102890825

Frequently Asked Questions

What is the IUPAC name of 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide (CID 43397906) is 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide is NC(=O)C1CCCN(C(=O)C2=NNC(=O)CC2)C1.
What is the InChIKey of 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is DQKVLIPGRPETCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c12-10(17)7-2-1-5-15(6-7)11(18)8-3-4-9(16)14-13-8/h7H,1-6H2,(H2,12,17)(H,14,16).
What are the key properties of 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide?
1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 252.27 g/mol, XLogP of -1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 43397906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).