3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline

C17H23N3 — CID 105326250

IUPAC3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCCc1cccc(C(NN)c2cccc(N(C)C)c2)c1
InChIInChI=1S/C17H23N3/c1-4-13-7-5-8-14(11-13)17(19-18)15-9-6-10-16(12-15)20(2)3/h5-12,17,19H,4,18H2,1-3H3
InChIKeyZLOBUDWOLQIJPP-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.87
Rot. Bonds5

About 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline

3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline (PubChem CID 105326250) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline
PubChem CID105326250
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCCc1cccc(C(NN)c2cccc(N(C)C)c2)c1
InChIInChI=1S/C17H23N3/c1-4-13-7-5-8-14(11-13)17(19-18)15-9-6-10-16(12-15)20(2)3/h5-12,17,19H,4,18H2,1-3H3
InChIKeyZLOBUDWOLQIJPP-UHFFFAOYSA-N
XLogP2.87
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-[hydrazinyl(phenyl)methyl]-N,N-dimethylaniline
CID 105282900
[(3-ethylphenyl)-(3-iodophenyl)methyl]hydrazine
CID 105326224
[(4-chlorophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105193218
3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline
CID 105284037
[(3-ethylphenyl)-pyrimidin-5-ylmethyl]hydrazine
CID 102924271
[(3-ethylphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190750
3-[furan-2-yl(hydrazinyl)methyl]-N,N-dimethylaniline
CID 105305991
[(3-ethylphenyl)-(2H-triazol-4-yl)methyl]hydrazine
CID 105254632
3-[hydrazinyl-(1-methylpyrazol-4-yl)methyl]-N,N-dimethylaniline
CID 105288676
[(2,5-dibromophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105326320
[(2,5-difluorophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105219304
3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline
CID 105321186

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The IUPAC name of 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline (CID 105326250) is 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline.
What is the SMILES notation for 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The canonical SMILES for 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline is CCc1cccc(C(NN)c2cccc(N(C)C)c2)c1.
What is the InChIKey of 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The InChIKey is ZLOBUDWOLQIJPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-4-13-7-5-8-14(11-13)17(19-18)15-9-6-10-16(12-15)20(2)3/h5-12,17,19H,4,18H2,1-3H3.
What are the key properties of 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline has a molecular weight of 269.39 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline is sourced from PubChem (CID 105326250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).