N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide

C19H24N4O2 — CID 75490694

IUPACN-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide
SMILESCOc1ccc(N2CCCC(C(=O)N(C)Cc3ccccc3)C2)nn1
InChIInChI=1S/C19H24N4O2/c1-22(13-15-7-4-3-5-8-15)19(24)16-9-6-12-23(14-16)17-10-11-18(25-2)21-20-17/h3-5,7-8,10-11,16H,6,9,12-14H2,1-2H3
InChIKeyNWVQJKWZTDFVCQ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.36
Rot. Bonds5

About N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide

N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide (PubChem CID 75490694) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide
PubChem CID75490694
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide
SMILESCOc1ccc(N2CCCC(C(=O)N(C)Cc3ccccc3)C2)nn1
InChIInChI=1S/C19H24N4O2/c1-22(13-15-7-4-3-5-8-15)19(24)16-9-6-12-23(14-16)17-10-11-18(25-2)21-20-17/h3-5,7-8,10-11,16H,6,9,12-14H2,1-2H3
InChIKeyNWVQJKWZTDFVCQ-UHFFFAOYSA-N
XLogP2.36
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-acetyl-N-benzyl-N-methylpiperidine-3-carboxamide
CID 110686080
(3S)-1-(6-methoxypyridazin-3-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 97496309
(3R)-N-benzyl-N-methyl-1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide
CID 92893329
N-[(2-methoxyphenyl)methyl]-1-(6-methoxypyridazin-3-yl)piperidine-3-carboxamide
CID 71706569
N-benzyl-N-methyl-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 71778492
N-[(4-chlorophenyl)methyl]-1-(6-methoxypyridazin-3-yl)piperidine-3-carboxamide
CID 71701098
N-benzyl-1-(3,4-dimethoxyphenyl)sulfonyl-N-methylpiperidine-3-carboxamide
CID 6490719
(3R)-N-benzyl-1-[2-(3-methoxypropyl)-1,3-dioxoisoindol-4-yl]-N-methylpiperidine-3-carboxamide
CID 42480022
(3R)-N-(3-methoxypropyl)-1-(6-methoxypyridazin-3-yl)piperidine-3-carboxamide
CID 97265102
(3S)-N-(furan-2-ylmethyl)-1-(6-methoxypyridazin-3-yl)piperidine-3-carboxamide
CID 97264818
N-[(3-chlorophenyl)methyl]-N-methyl-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 46597069
N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 134034927

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide (CID 75490694) is N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide is COc1ccc(N2CCCC(C(=O)N(C)Cc3ccccc3)C2)nn1.
What is the InChIKey of N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide?
The InChIKey is NWVQJKWZTDFVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22(13-15-7-4-3-5-8-15)19(24)16-9-6-12-23(14-16)17-10-11-18(25-2)21-20-17/h3-5,7-8,10-11,16H,6,9,12-14H2,1-2H3.
What are the key properties of N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide?
N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.36, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(6-methoxypyridazin-3-yl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 75490694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).