N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

C13H22N4O2 — CID 110752381

IUPACN-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C13H22N4O2/c1-16(9-10-17-7-3-2-4-8-17)13(19)11-5-6-12(18)15-14-11/h2-10H2,1H3,(H,15,18)
InChIKeyFYBMRXHIZCOIFA-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.20
Rot. Bonds4

About N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 110752381) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID110752381
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C13H22N4O2/c1-16(9-10-17-7-3-2-4-8-17)13(19)11-5-6-12(18)15-14-11/h2-10H2,1H3,(H,15,18)
InChIKeyFYBMRXHIZCOIFA-UHFFFAOYSA-N
XLogP0.20
TPSA65.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[methyl-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]acetate
CID 55003937
N-methyl-N-(2-piperidin-1-ylethyl)pyridine-4-carboxamide
CID 110753397
N-[(3,5-dichlorophenyl)methyl]-N-methyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60960333
N-[(2-fluorophenyl)methyl]-N-methyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 43397517
N-[(5-bromothiophen-3-yl)methyl]-N-methyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 54983860
2-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide
CID 63207878
2-fluoro-N-methyl-N-(2-piperidin-1-ylethyl)benzamide
CID 110753364
6-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-2-carboxamide
CID 113323599
N-methyl-N-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 46981642
4-amino-N-methyl-5-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 63207158
4-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrole-2-carboxamide
CID 63206983
N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 56722201

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 110752381) is N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is CN(CCN1CCCCC1)C(=O)C1=NNC(=O)CC1.
What is the InChIKey of N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is FYBMRXHIZCOIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-16(9-10-17-7-3-2-4-8-17)13(19)11-5-6-12(18)15-14-11/h2-10H2,1H3,(H,15,18).
What are the key properties of N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 0.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-(2-piperidin-1-ylethyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 110752381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).