N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide

C13H18N2O4 — CID 17357908

IUPACN'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide
SMILESCCOCCC(=O)NNC(=O)c1ccccc1OC
InChIInChI=1S/C13H18N2O4/c1-3-19-9-8-12(16)14-15-13(17)10-6-4-5-7-11(10)18-2/h4-7H,3,8-9H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyDHXZJGCDRYDINT-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.88
Rot. Bonds6

About N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide

N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide (PubChem CID 17357908) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide.

Molecular Properties

Compound NameN'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide
PubChem CID17357908
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC NameN'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide
SMILESCCOCCC(=O)NNC(=O)c1ccccc1OC
InChIInChI=1S/C13H18N2O4/c1-3-19-9-8-12(16)14-15-13(17)10-6-4-5-7-11(10)18-2/h4-7H,3,8-9H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyDHXZJGCDRYDINT-UHFFFAOYSA-N
XLogP0.88
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.88
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'-(3-ethoxypropanoyl)-2-(2-methylpropoxy)benzohydrazide
CID 17357941
N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 18159247
N'-(2-ethoxyacetyl)-2-(2-methoxyethoxy)benzohydrazide
CID 17140943
2-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 17122844
N-(2-chlorophenyl)-4-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-4-oxobutanamide
CID 17122868
N'-(2-ethoxyacetyl)-2-(2-phenoxyethoxy)benzohydrazide
CID 17140922
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
CID 17122823
N'-[2-(2-tert-butylphenoxy)acetyl]-3-ethoxypropanehydrazide
CID 17050964
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
N-[4-(2-ethoxyethoxy)phenyl]-2-methoxybenzamide
CID 17130584
4-[2-(2-ethoxybenzoyl)hydrazinyl]-4-oxo-N-phenylbutanamide
CID 4926492
N-[(hexanoylamino)carbamothioyl]-2-methoxybenzamide
CID 4955656

Frequently Asked Questions

What is the IUPAC name of N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide?
The IUPAC name of N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide (CID 17357908) is N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide.
What is the SMILES notation for N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide?
The canonical SMILES for N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide is CCOCCC(=O)NNC(=O)c1ccccc1OC.
What is the InChIKey of N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide?
The InChIKey is DHXZJGCDRYDINT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-3-19-9-8-12(16)14-15-13(17)10-6-4-5-7-11(10)18-2/h4-7H,3,8-9H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide?
N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide has a molecular weight of 266.30 g/mol, XLogP of 0.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-ethoxypropanoyl)-2-methoxybenzohydrazide is sourced from PubChem (CID 17357908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).