4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide

C13H21N3O3 — CID 113468064

IUPAC4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
SMILESCOCCN(CCO)C(=O)c1ccc(NN)cc1C
InChIInChI=1S/C13H21N3O3/c1-10-9-11(15-14)3-4-12(10)13(18)16(5-7-17)6-8-19-2/h3-4,9,15,17H,5-8,14H2,1-2H3
InChIKeyNNBQGXUOAGXWNO-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.36
Rot. Bonds7

About 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide

4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide (PubChem CID 113468064) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
PubChem CID113468064
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
SMILESCOCCN(CCO)C(=O)c1ccc(NN)cc1C
InChIInChI=1S/C13H21N3O3/c1-10-9-11(15-14)3-4-12(10)13(18)16(5-7-17)6-8-19-2/h3-4,9,15,17H,5-8,14H2,1-2H3
InChIKeyNNBQGXUOAGXWNO-UHFFFAOYSA-N
XLogP0.36
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113467625
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113339830
5-chloro-2-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 113468065
5-bromo-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113351116
2-fluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-methylbenzamide
CID 115902345
N-ethyl-4-hydrazinyl-N-(2-methoxyethyl)benzamide
CID 62248057
N-(2-hydroxyethyl)-3-methoxy-N-(2-methoxyethyl)-4-methylbenzamide
CID 115772556
methyl 3-[(4-fluoro-2-methylbenzoyl)-(2-methoxyethyl)amino]propanoate
CID 115745885
3-(3-fluoro-4-methylphenyl)-1-(2-hydroxyethyl)-1-(2-methoxyethyl)urea
CID 111431069
4-hydrazinyl-N-(1-hydroxypropan-2-yl)-N,2-dimethylbenzamide
CID 104554447
1-(2-hydroxyethyl)-1-(2-methoxyethyl)-3-[4-methyl-3-(trifluoromethyl)phenyl]urea
CID 111473504
4-hydroxy-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 115902414

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The IUPAC name of 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide (CID 113468064) is 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide.
What is the SMILES notation for 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The canonical SMILES for 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide is COCCN(CCO)C(=O)c1ccc(NN)cc1C.
What is the InChIKey of 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The InChIKey is NNBQGXUOAGXWNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-10-9-11(15-14)3-4-12(10)13(18)16(5-7-17)6-8-19-2/h3-4,9,15,17H,5-8,14H2,1-2H3.
What are the key properties of 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide has a molecular weight of 267.33 g/mol, XLogP of 0.36, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide is sourced from PubChem (CID 113468064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).