3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide

C14H23N3O2 — CID 64566055

IUPAC3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide
SMILESCOCCCN(C)CC(C(=O)NN)c1ccccc1
InChIInChI=1S/C14H23N3O2/c1-17(9-6-10-19-2)11-13(14(18)16-15)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11,15H2,1-2H3,(H,16,18)
InChIKeyDBWLRVFQLAVABT-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.73
Rot. Bonds8

About 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide

3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide (PubChem CID 64566055) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide.

Molecular Properties

Compound Name3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide
PubChem CID64566055
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide
SMILESCOCCCN(C)CC(C(=O)NN)c1ccccc1
InChIInChI=1S/C14H23N3O2/c1-17(9-6-10-19-2)11-13(14(18)16-15)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11,15H2,1-2H3,(H,16,18)
InChIKeyDBWLRVFQLAVABT-UHFFFAOYSA-N
XLogP0.73
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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-amino-N-[2-[3-methoxypropyl(methyl)amino]ethyl]-2-phenylacetamide
CID 119892857
3-[methyl(2-methylbutyl)amino]-2-phenylpropanehydrazide
CID 64567890
3-(3-methoxypropylsulfanyl)-2-phenylpropanehydrazide
CID 64560373
3-[methyl(3-methylbutan-2-yl)amino]-2-phenylpropanehydrazide
CID 64565017
2-(3-methoxypropoxy)-2-phenylacetohydrazide
CID 63587948
N-cyclopropyl-2-[(3-hydrazinyl-3-oxo-2-phenylpropyl)-methylamino]acetamide
CID 64566681
3-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-methyl-3-phenylpropanamide
CID 119855410
methyl 3-[ethyl(methyl)amino]-2-phenylpropanoate
CID 64567687
N'-(3-methoxypropyl)-N,N'-dimethyl-1-phenylpropane-1,3-diamine
CID 55140895
3-[ethyl(2-methylpropyl)amino]-2-phenylpropanehydrazide
CID 64565838
2-[2-methoxyethyl(pentan-3-yl)amino]-2-phenylacetohydrazide
CID 63577148
3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide
CID 64566065

Frequently Asked Questions

What is the IUPAC name of 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide?
The IUPAC name of 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide (CID 64566055) is 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide.
What is the SMILES notation for 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide?
The canonical SMILES for 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide is COCCCN(C)CC(C(=O)NN)c1ccccc1.
What is the InChIKey of 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide?
The InChIKey is DBWLRVFQLAVABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-17(9-6-10-19-2)11-13(14(18)16-15)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11,15H2,1-2H3,(H,16,18).
What are the key properties of 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide?
3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide has a molecular weight of 265.36 g/mol, XLogP of 0.73, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-methoxypropyl(methyl)amino]-2-phenylpropanehydrazide is sourced from PubChem (CID 64566055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).