N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

C15H19N3O3 — CID 51262026

IUPACN-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCOc1cccc(CN(C)C(=O)C2=NN(C)C(=O)CC2)c1
InChIInChI=1S/C15H19N3O3/c1-17(10-11-5-4-6-12(9-11)21-3)15(20)13-7-8-14(19)18(2)16-13/h4-6,9H,7-8,10H2,1-3H3
InChIKeyPITYTEFAJFEIHJ-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.26
Rot. Bonds4

About N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (PubChem CID 51262026) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
PubChem CID51262026
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC NameN-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCOc1cccc(CN(C)C(=O)C2=NN(C)C(=O)CC2)c1
InChIInChI=1S/C15H19N3O3/c1-17(10-11-5-4-6-12(9-11)21-3)15(20)13-7-8-14(19)18(2)16-13/h4-6,9H,7-8,10H2,1-3H3
InChIKeyPITYTEFAJFEIHJ-UHFFFAOYSA-N
XLogP1.26
TPSA62.21 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 22070414
5-amino-N-[(3-methoxyphenyl)methyl]-N,1-dimethylpyrazole-4-carboxamide
CID 115330502
5-amino-N-[(3-methoxyphenyl)methyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 61418056
N-[(3-methoxyphenyl)methyl]-N-methylcyclopropanecarboxamide
CID 60630648
2,5-dihydroxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 107722488
3-amino-N-[(3-methoxyphenyl)methyl]-N-methylthiophene-2-carboxamide
CID 54980615
ethyl N-[(3-methoxyphenyl)methyl]-N-methylcarbamate
CID 60636271
N-[2-[(3-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 31211499
N-[(3-methoxyphenyl)methyl]-N,1,6-trimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridine-4-carboxamide
CID 39910874
2,5-dibromo-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 114371373
N,1-dimethyl-N-[(3-methyl-2-pyridinyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 154886194
5-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylpyridine-2-carboxamide
CID 63722518

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (CID 51262026) is N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is COc1cccc(CN(C)C(=O)C2=NN(C)C(=O)CC2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is PITYTEFAJFEIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-17(10-11-5-4-6-12(9-11)21-3)15(20)13-7-8-14(19)18(2)16-13/h4-6,9H,7-8,10H2,1-3H3.
What are the key properties of N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 289.33 g/mol, XLogP of 1.26, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 51262026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).