N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide

C18H26N6O2 — CID 53203994

IUPACN-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCc1nn(C)cc1CN(C)C(=O)C1CCCN(c2cnn(C)c(=O)c2)C1
InChIInChI=1S/C18H26N6O2/c1-13-15(11-22(3)20-13)10-21(2)18(26)14-6-5-7-24(12-14)16-8-17(25)23(4)19-9-16/h8-9,11,14H,5-7,10,12H2,1-4H3
InChIKeyVSQRBZCFUGHABD-UHFFFAOYSA-N
MW358.45 g/mol
LogP0.70
Rot. Bonds4

About N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide

N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (PubChem CID 53203994) has the molecular formula C18H26N6O2 and a molecular weight of 358.45 g/mol. Its IUPAC name is N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
PubChem CID53203994
Molecular FormulaC18H26N6O2
Molecular Weight358.45 g/mol
Exact Mass358.21
IUPAC NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCc1nn(C)cc1CN(C)C(=O)C1CCCN(c2cnn(C)c(=O)c2)C1
InChIInChI=1S/C18H26N6O2/c1-13-15(11-22(3)20-13)10-21(2)18(26)14-6-5-7-24(12-14)16-8-17(25)23(4)19-9-16/h8-9,11,14H,5-7,10,12H2,1-4H3
InChIKeyVSQRBZCFUGHABD-UHFFFAOYSA-N
XLogP0.70
TPSA76.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclohexylmethyl)-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-6-oxo-3-piperidinecarboxamide
CID 24817829
1'-[(5-methyl-1-propyl-1H-pyrazol-4-yl)carbonyl]-1,4'-bipiperidine
CID 72843662
N,1,3-trimethyl-N-(1-methylpiperidin-4-yl)pyrazole-4-carboxamide
CID 42352823
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 53202069
N-[(1,3-Dimethyl-1H-pyrazol-4-YL)methyl]-N-methyl-1-(6-oxo-1-propyl-1,6-dihydro-4-pyridazinyl)-4-piperidinecarboxamide
CID 53202222
1-(6-oxo-1,6-dihydropyridazin-4-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]piperidine-3-carboxamide
CID 53203850
N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)-N-[3-(1,3,5-trimethylpyrazol-4-yl)propyl]piperidine-3-carboxamide
CID 53203989
1-[(3-methyl-1-propyl-1H-pyrazol-4-yl)carbonyl]-3-piperidinecarbonitrile
CID 72939176
N-[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 96006651
1,5-dimethyl-N-{[1-(3-methylbut-2-en-1-yl)piperidin-4-yl]methyl}-1H-pyrazole-4-carboxamide
CID 131901108
N-[(3S)-1-(1-ethyl-3-methylpyrazole-4-carbonyl)piperidin-3-yl]-2-methyl-N-(3-pyrrolidin-1-ylpropyl)propanamide
CID 164630818
[(3S)-1-[(1,5-dimethylpyrazol-4-yl)methyl]-3-fluoropiperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 164634702

Frequently Asked Questions

What is the IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (CID 53203994) is N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is Cc1nn(C)cc1CN(C)C(=O)C1CCCN(c2cnn(C)c(=O)c2)C1.
What is the InChIKey of N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The InChIKey is VSQRBZCFUGHABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O2/c1-13-15(11-22(3)20-13)10-21(2)18(26)14-6-5-7-24(12-14)16-8-17(25)23(4)19-9-16/h8-9,11,14H,5-7,10,12H2,1-4H3.
What are the key properties of N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide has a molecular weight of 358.45 g/mol, XLogP of 0.70, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 53203994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).