N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide

C18H20N2O4 — CID 17353579

IUPACN'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C18H20N2O4/c1-13-4-3-5-15(12-13)18(22)20-19-17(21)14-6-8-16(9-7-14)24-11-10-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyRJPMYYFSIZXJSP-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.10
Rot. Bonds6

About N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide

N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide (PubChem CID 17353579) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide.

Molecular Properties

Compound NameN'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide
PubChem CID17353579
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C18H20N2O4/c1-13-4-3-5-15(12-13)18(22)20-19-17(21)14-6-8-16(9-7-14)24-11-10-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyRJPMYYFSIZXJSP-UHFFFAOYSA-N
XLogP2.10
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-heptoxybenzoyl)-3-methylbenzohydrazide
CID 4950738
4-(2-ethoxyethoxy)-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
CID 17113056
4-hexoxy-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
CID 4934547
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
N-[[(3-methylbenzoyl)amino]carbamothioyl]-3-(2-phenoxyethoxy)benzamide
CID 4955383
N'-benzoyl-3-(2-phenoxyethoxy)benzohydrazide
CID 4955128
(3-methylphenyl) 4-(2-methoxyethoxy)benzoate
CID 17178146
N'-[2-(4-chlorophenoxy)acetyl]-3-methylbenzohydrazide
CID 732324
N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
CID 17353575
N'-(4-chlorobenzoyl)-3-methylbenzohydrazide
CID 959739
N-[2-[(4-methoxybenzoyl)amino]ethyl]-3-methylbenzamide
CID 108537853
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321

Frequently Asked Questions

What is the IUPAC name of N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide?
The IUPAC name of N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide (CID 17353579) is N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide.
What is the SMILES notation for N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide?
The canonical SMILES for N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide is COCCOc1ccc(C(=O)NNC(=O)c2cccc(C)c2)cc1.
What is the InChIKey of N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide?
The InChIKey is RJPMYYFSIZXJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-13-4-3-5-15(12-13)18(22)20-19-17(21)14-6-8-16(9-7-14)24-11-10-23-2/h3-9,12H,10-11H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide?
N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide has a molecular weight of 328.37 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide is sourced from PubChem (CID 17353579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).