1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide

C17H20N4O5 — CID 24553901

IUPAC1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide
SMILESCOCCn1nc(C(=O)NNC(=O)Cc2ccc(OC)cc2)ccc1=O
InChIInChI=1S/C17H20N4O5/c1-25-10-9-21-16(23)8-7-14(20-21)17(24)19-18-15(22)11-12-3-5-13(26-2)6-4-12/h3-8H,9-11H2,1-2H3,(H,18,22)(H,19,24)
InChIKeySEXUOVZNQKOJQH-UHFFFAOYSA-N
MW360.37 g/mol
LogP-0.10
Rot. Bonds7

About 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide

1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide (PubChem CID 24553901) has the molecular formula C17H20N4O5 and a molecular weight of 360.37 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide
PubChem CID24553901
Molecular FormulaC17H20N4O5
Molecular Weight360.37 g/mol
Exact Mass360.14
IUPAC Name1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide
SMILESCOCCn1nc(C(=O)NNC(=O)Cc2ccc(OC)cc2)ccc1=O
InChIInChI=1S/C17H20N4O5/c1-25-10-9-21-16(23)8-7-14(20-21)17(24)19-18-15(22)11-12-3-5-13(26-2)6-4-12/h3-8H,9-11H2,1-2H3,(H,18,22)(H,19,24)
InChIKeySEXUOVZNQKOJQH-UHFFFAOYSA-N
XLogP-0.10
TPSA111.55 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxyethyl)-N-[(6-methoxynaphthalen-2-yl)methyl]-6-oxopyridazine-3-carboxamide
CID 46691833
N-(3,5-dimethoxyphenyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 24537228
1-(2-methoxyethyl)-6-oxo-N'-[5-(phenoxymethyl)furan-2-carbonyl]pyridazine-3-carbohydrazide
CID 24515498
1-(2-methoxyethyl)-6-oxo-N-[[4-(trifluoromethoxy)phenyl]methyl]pyridazine-3-carboxamide
CID 17396464
N-[(2R)-2-hydroxypropyl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 83031566
N'-(3-chlorobenzoyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carbohydrazide
CID 37349424
methyl 3-[[1-(2-methoxyethyl)-6-oxopyridazine-3-carbonyl]amino]propanoate
CID 47120194
N'-[2-(4-chlorophenyl)acetyl]-1-methyl-6-oxopyridazine-3-carbohydrazide
CID 51163217
N-[(2R)-1-hydroxypropan-2-yl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 79027672
1-(2-methoxyethyl)-6-oxo-N-(4-phenoxyphenyl)pyridazine-3-carboxamide
CID 33238572
2-[[1-(2-methoxyethyl)-6-oxopyridazine-3-carbonyl]amino]oxyacetic acid
CID 63930762
1-(2-methoxyethyl)-N-(3-methoxy-1H-1,2,4-triazol-5-yl)-6-oxopyridazine-3-carboxamide
CID 83090099

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide?
The IUPAC name of 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide (CID 24553901) is 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide.
What is the SMILES notation for 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide?
The canonical SMILES for 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide is COCCn1nc(C(=O)NNC(=O)Cc2ccc(OC)cc2)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide?
The InChIKey is SEXUOVZNQKOJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O5/c1-25-10-9-21-16(23)8-7-14(20-21)17(24)19-18-15(22)11-12-3-5-13(26-2)6-4-12/h3-8H,9-11H2,1-2H3,(H,18,22)(H,19,24).
What are the key properties of 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide?
1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide has a molecular weight of 360.37 g/mol, XLogP of -0.10, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N'-[2-(4-methoxyphenyl)acetyl]-6-oxopyridazine-3-carbohydrazide is sourced from PubChem (CID 24553901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).