1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane

C22H34Cl2N2 — CID 143170234

IUPAC1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane
SMILESCC.CC.CCc1cccc(CN(Cc2c(Cl)cccc2Cl)N(C)C)c1
InChIInChI=1S/C18H22Cl2N2.2C2H6/c1-4-14-7-5-8-15(11-14)12-22(21(2)3)13-16-17(19)9-6-10-18(16)20;2*1-2/h5-11H,4,12-13H2,1-3H3;2*1-2H3
InChIKeyHVUSKONONHOBFS-UHFFFAOYSA-N
MW397.43 g/mol
LogP7.09
Rot. Bonds6

About 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane

1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane (PubChem CID 143170234) has the molecular formula C22H34Cl2N2 and a molecular weight of 397.43 g/mol. Its IUPAC name is 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane.

Molecular Properties

Compound Name1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane
PubChem CID143170234
Molecular FormulaC22H34Cl2N2
Molecular Weight397.43 g/mol
Exact Mass396.21
IUPAC Name1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane
SMILESCC.CC.CCc1cccc(CN(Cc2c(Cl)cccc2Cl)N(C)C)c1
InChIInChI=1S/C18H22Cl2N2.2C2H6/c1-4-14-7-5-8-15(11-14)12-22(21(2)3)13-16-17(19)9-6-10-18(16)20;2*1-2/h5-11H,4,12-13H2,1-3H3;2*1-2H3
InChIKeyHVUSKONONHOBFS-UHFFFAOYSA-N
XLogP7.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.43
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane?
The IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane (CID 143170234) is 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane.
What is the SMILES notation for 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane?
The canonical SMILES for 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane is CC.CC.CCc1cccc(CN(Cc2c(Cl)cccc2Cl)N(C)C)c1.
What is the InChIKey of 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane?
The InChIKey is HVUSKONONHOBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22Cl2N2.2C2H6/c1-4-14-7-5-8-15(11-14)12-22(21(2)3)13-16-17(19)9-6-10-18(16)20;2*1-2/h5-11H,4,12-13H2,1-3H3;2*1-2H3.
What are the key properties of 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane?
1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane has a molecular weight of 397.43 g/mol, XLogP of 7.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichlorophenyl)methyl]-1-[(3-ethylphenyl)methyl]-2,2-dimethylhydrazine;ethane is sourced from PubChem (CID 143170234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).