N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide

C11H16N4O2 — CID 155021012

IUPACN-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
SMILESCn1nc(NC(=O)N2CCCCC2)ccc1=O
InChIInChI=1S/C11H16N4O2/c1-14-10(16)6-5-9(13-14)12-11(17)15-7-3-2-4-8-15/h5-6H,2-4,7-8H2,1H3,(H,12,13,17)
InChIKeyKSTRKCVRQXSIDD-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.80
Rot. Bonds1

About N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide

N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide (PubChem CID 155021012) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
PubChem CID155021012
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
SMILESCn1nc(NC(=O)N2CCCCC2)ccc1=O
InChIInChI=1S/C11H16N4O2/c1-14-10(16)6-5-9(13-14)12-11(17)15-7-3-2-4-8-15/h5-6H,2-4,7-8H2,1H3,(H,12,13,17)
InChIKeyKSTRKCVRQXSIDD-UHFFFAOYSA-N
XLogP0.80
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Cyano-3-[4-[3-(dimethylamino)-6-oxopyridazin-1-yl]butyl]-2-methylguanidine
CID 12850780
[1-[(1-Methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite
CID 155020988
N-(1-methyl-6-oxopyridazin-3-yl)-4-oxopiperidine-1-carboxamide
CID 154662237
N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide
CID 154662241
1-(1-Methyl-6-oxopyridazin-3-yl)-3-propylurea
CID 154662384
1-Methyl-3-(1-methyl-6-oxopyridazin-3-yl)-1-propylurea
CID 154662458
4-amino-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 154662473
1-Methyl-3-(1-methyl-6-oxopyridazin-3-yl)-1-propylurea;molecular hydrogen
CID 154662480
1-Ethyl-1-(3-methylbutyl)-3-(1-methyl-6-oxopyridazin-3-yl)urea
CID 155020983
[1-[(1-Methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl]carbamic acid
CID 156368831
4-methoxy-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 156375699
4-hydroxy-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 156375727

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide?
The IUPAC name of N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide (CID 155021012) is N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide is Cn1nc(NC(=O)N2CCCCC2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide?
The InChIKey is KSTRKCVRQXSIDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-14-10(16)6-5-9(13-14)12-11(17)15-7-3-2-4-8-15/h5-6H,2-4,7-8H2,1H3,(H,12,13,17).
What are the key properties of N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide?
N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 155021012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).