2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide

C13H21N3O3 — CID 63571903

IUPAC2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide
SMILESCCN(CCO)CCOc1ccccc1C(=O)NN
InChIInChI=1S/C13H21N3O3/c1-2-16(7-9-17)8-10-19-12-6-4-3-5-11(12)13(18)15-14/h3-6,17H,2,7-10,14H2,1H3,(H,15,18)
InChIKeyWTCQDNPQEAQFLT-UHFFFAOYSA-N
MW267.33 g/mol
LogP-0.02
Rot. Bonds8

About 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide

2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide (PubChem CID 63571903) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide.

Molecular Properties

Compound Name2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide
PubChem CID63571903
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide
SMILESCCN(CCO)CCOc1ccccc1C(=O)NN
InChIInChI=1S/C13H21N3O3/c1-2-16(7-9-17)8-10-19-12-6-4-3-5-11(12)13(18)15-14/h3-6,17H,2,7-10,14H2,1H3,(H,15,18)
InChIKeyWTCQDNPQEAQFLT-UHFFFAOYSA-N
XLogP-0.02
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[butyl(ethyl)amino]ethoxy]benzohydrazide
CID 63569772
2-[2-[ethyl(2-methylbutyl)amino]ethoxy]benzohydrazide
CID 79482895
2-[2-[butan-2-yl(ethyl)amino]ethoxy]benzohydrazide
CID 63572715
2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
CID 63574053
2-pentoxybenzohydrazide
CID 54793215
1-[2-[2-[2-hydroxyethyl(2-methoxyethyl)amino]ethoxy]phenyl]ethanone
CID 115613776
2-[2-[2,2-dimethylpropyl(methyl)amino]ethoxy]benzohydrazide
CID 63578013
1-[2-[2-(diethylamino)ethoxy]phenyl]propan-1-one;hydrobromide
CID 117068814
2-[2-[methyl(1-methylsulfanylpropan-2-yl)amino]ethoxy]benzohydrazide
CID 115988023
2-[2-[2-cyanoethyl(methyl)amino]ethoxy]benzohydrazide
CID 63570448
1-[2-[2-(diethylamino)ethoxy]phenyl]butan-1-one
CID 30287
2-[ethyl-[2-(2-nitrophenoxy)ethyl]amino]ethanol
CID 60509442

Frequently Asked Questions

What is the IUPAC name of 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide?
The IUPAC name of 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide (CID 63571903) is 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide.
What is the SMILES notation for 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide?
The canonical SMILES for 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide is CCN(CCO)CCOc1ccccc1C(=O)NN.
What is the InChIKey of 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide?
The InChIKey is WTCQDNPQEAQFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-2-16(7-9-17)8-10-19-12-6-4-3-5-11(12)13(18)15-14/h3-6,17H,2,7-10,14H2,1H3,(H,15,18).
What are the key properties of 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide?
2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide has a molecular weight of 267.33 g/mol, XLogP of -0.02, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide is sourced from PubChem (CID 63571903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).