N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide

C15H18ClN3O2 — CID 75420351

IUPACN-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide
SMILESCCCN(C(=O)C1=NN(C)C(=O)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C15H18ClN3O2/c1-3-10-19(12-6-4-11(16)5-7-12)15(21)13-8-9-14(20)18(2)17-13/h4-7H,3,8-10H2,1-2H3
InChIKeyHZJSMWVKWMPRSB-UHFFFAOYSA-N
MW307.78 g/mol
LogP2.69
Rot. Bonds4

About N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide

N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide (PubChem CID 75420351) has the molecular formula C15H18ClN3O2 and a molecular weight of 307.78 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide
PubChem CID75420351
Molecular FormulaC15H18ClN3O2
Molecular Weight307.78 g/mol
Exact Mass307.11
IUPAC NameN-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide
SMILESCCCN(C(=O)C1=NN(C)C(=O)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C15H18ClN3O2/c1-3-10-19(12-6-4-11(16)5-7-12)15(21)13-8-9-14(20)18(2)17-13/h4-7H,3,8-10H2,1-2H3
InChIKeyHZJSMWVKWMPRSB-UHFFFAOYSA-N
XLogP2.69
TPSA52.98 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.78
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3H-Pyrazol-3-one, 2-(4-chlorophenyl)-2,4-dihydro-5-methyl-
CID 83055
3-Methyl-1-(3'-chlorophenyl)-2-pyrazolin-5-one
CID 66656
3H-Pyrazol-3-one, 2-(2-chlorophenyl)-2,4-dihydro-5-methyl-
CID 84534
2-(4-Chlorophenyl)-5-methyl-3-oxo-6-(piperidin-1-ylcarbonyl)-2,3-dihydropyridazine-4-carbonitrile
CID 1506741
(3E)-N-(4-chlorophenyl)-3-{2-[oxo(piperidin-1-yl)acetyl]hydrazinylidene}butanamide
CID 9594063
(4Z)-2-(4-chlorophenyl)-4-(dimethylaminomethylene)-5-methyl-pyrazol-3-one
CID 5446030
N-(4-chlorophenyl)-3-(propionylhydrazono)butanamide
CID 9725886
N-(4-chlorophenyl)-6-oxo-1-propyl-1,6-dihydropyridazine-3-carboxamide
CID 18081279
N-methyl-6-oxo-N,1-diphenyl-4,5-dihydropyridazine-3-carboxamide
CID 18190698
(4Z)-4-[(4-acetylpiperazin-1-yl)methylene]-2-(4-chlorophenyl)-5-methyl-pyrazol-3-one
CID 45270152
N-(4-chloro-2-fluorophenyl)-3-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)propanamide
CID 71810813
N-(3-chlorophenyl)-1-methyl-6-oxo-N-(2,2,2-trifluoroethyl)pyridazine-3-carboxamide
CID 71978534

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide (CID 75420351) is N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide is CCCN(C(=O)C1=NN(C)C(=O)CC1)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is HZJSMWVKWMPRSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O2/c1-3-10-19(12-6-4-11(16)5-7-12)15(21)13-8-9-14(20)18(2)17-13/h4-7H,3,8-10H2,1-2H3.
What are the key properties of N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide?
N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 307.78 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 75420351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).