2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide

C14H23N3O2 — CID 81068442

IUPAC2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide
SMILESCC(C)OCCN(C)Cc1ccccc1C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-11(2)19-9-8-17(3)10-12-6-4-5-7-13(12)14(18)16-15/h4-7,11H,8-10,15H2,1-3H3,(H,16,18)
InChIKeyAJXXYRPMJQNXJU-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.15
Rot. Bonds7

About 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide

2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide (PubChem CID 81068442) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide.

Molecular Properties

Compound Name2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide
PubChem CID81068442
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide
SMILESCC(C)OCCN(C)Cc1ccccc1C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-11(2)19-9-8-17(3)10-12-6-4-5-7-13(12)14(18)16-15/h4-7,11H,8-10,15H2,1-3H3,(H,16,18)
InChIKeyAJXXYRPMJQNXJU-UHFFFAOYSA-N
XLogP1.15
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(dimethylamino)ethyl-methylamino]methyl]benzohydrazide
CID 55227180
3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]furan-2-carbohydrazide
CID 81067916
2-[[2-cyanopropyl(methyl)amino]methyl]benzohydrazide
CID 63583398
N-methyl-N-[[2-(methylaminomethyl)phenyl]methyl]-2-propan-2-yloxyethanamine
CID 81067280
2-[[propan-2-yl(propyl)amino]methyl]benzohydrazide
CID 55212652
5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thiophene-2-carbohydrazide
CID 81067684
2-[methyl(2-propan-2-yloxyethyl)amino]-2-phenylacetohydrazide
CID 81068829
2-bromo-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
CID 82982903
N-[(2-hydrazinylquinolin-3-yl)methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 81063048
2-(4-methylpentan-2-yloxymethyl)benzohydrazide
CID 63574397
2-[[2-methylpropyl(pentan-3-yl)amino]methyl]benzohydrazide
CID 79489331
2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
CID 82983294

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide?
The IUPAC name of 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide (CID 81068442) is 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide.
What is the SMILES notation for 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide?
The canonical SMILES for 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide is CC(C)OCCN(C)Cc1ccccc1C(=O)NN.
What is the InChIKey of 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide?
The InChIKey is AJXXYRPMJQNXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-11(2)19-9-8-17(3)10-12-6-4-5-7-13(12)14(18)16-15/h4-7,11H,8-10,15H2,1-3H3,(H,16,18).
What are the key properties of 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide?
2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide has a molecular weight of 265.36 g/mol, XLogP of 1.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide is sourced from PubChem (CID 81068442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).