N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide

C16H23N3O7 — CID 3971396

IUPACN,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide
SMILESCOc1cc(C(=O)NNC(=O)COCC(=O)N(C)C)cc(OC)c1OC
InChIInChI=1S/C16H23N3O7/c1-19(2)14(21)9-26-8-13(20)17-18-16(22)10-6-11(23-3)15(25-5)12(7-10)24-4/h6-7H,8-9H2,1-5H3,(H,17,20)(H,18,22)
InChIKeyJRXMBYOILRNHFO-UHFFFAOYSA-N
MW369.37 g/mol
LogP-0.42
Rot. Bonds8

About N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide

N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide (PubChem CID 3971396) has the molecular formula C16H23N3O7 and a molecular weight of 369.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide
PubChem CID3971396
Molecular FormulaC16H23N3O7
Molecular Weight369.37 g/mol
Exact Mass369.15
IUPAC NameN,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide
SMILESCOc1cc(C(=O)NNC(=O)COCC(=O)N(C)C)cc(OC)c1OC
InChIInChI=1S/C16H23N3O7/c1-19(2)14(21)9-26-8-13(20)17-18-16(22)10-6-11(23-3)15(25-5)12(7-10)24-4/h6-7H,8-9H2,1-5H3,(H,17,20)(H,18,22)
InChIKeyJRXMBYOILRNHFO-UHFFFAOYSA-N
XLogP-0.42
TPSA115.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.37
LogP ≤ 5-0.42
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-N',9-N'-bis(3,4,5-trimethoxybenzoyl)nonanedihydrazide
CID 3801032
N'-acetyl-3,4,5-trimethoxybenzohydrazide
CID 913637
3,4,5-trimethoxy-N'-(3-phenoxypropanoyl)benzohydrazide
CID 2117105
N,N-diethyl-3,3-dimethyl-5-oxo-5-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]pentanamide
CID 3955560
3,4,5-trimethoxy-N'-[2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]acetyl]benzohydrazide
CID 3971478
N'-[2-(3,4-dimethylphenyl)acetyl]-3,4,5-trimethoxybenzohydrazide
CID 4808541
3,4,5-trimethoxy-N'-[2-(4-propanoylphenoxy)acetyl]benzohydrazide
CID 2088517
N'-[2-(2,4-dichlorophenoxy)acetyl]-3,4,5-trimethoxybenzohydrazide
CID 2818575
3,4,5-trimethoxy-N'-(3-piperidin-1-ium-1-ylpropanoyl)benzohydrazide
CID 7448564
3,4,5-trimethoxy-N'-(4-oxo-4-phenylbutanoyl)benzohydrazide
CID 9399555
3,4,5-trimethoxy-N-(propylideneamino)benzamide
CID 3317143
N'-(3-cyclopentylpropanoyl)-3,4,5-trimethoxybenzohydrazide
CID 4043294

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide (CID 3971396) is N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide is COc1cc(C(=O)NNC(=O)COCC(=O)N(C)C)cc(OC)c1OC.
What is the InChIKey of N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide?
The InChIKey is JRXMBYOILRNHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O7/c1-19(2)14(21)9-26-8-13(20)17-18-16(22)10-6-11(23-3)15(25-5)12(7-10)24-4/h6-7H,8-9H2,1-5H3,(H,17,20)(H,18,22).
What are the key properties of N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide?
N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide has a molecular weight of 369.37 g/mol, XLogP of -0.42, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-oxo-2-[2-(3,4,5-trimethoxybenzoyl)hydrazinyl]ethoxy]acetamide is sourced from PubChem (CID 3971396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).