1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine

C9H13Cl2N3 — CID 116914952

IUPAC1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine
SMILESCN(C)C(NN)c1ccc(Cl)cc1Cl
InChIInChI=1S/C9H13Cl2N3/c1-14(2)9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,13H,12H2,1-2H3
InChIKeyWBXVYKYNYWAGGG-UHFFFAOYSA-N
MW234.13 g/mol
LogP2.02
Rot. Bonds3

About 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine

1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine (PubChem CID 116914952) has the molecular formula C9H13Cl2N3 and a molecular weight of 234.13 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine
PubChem CID116914952
Molecular FormulaC9H13Cl2N3
Molecular Weight234.13 g/mol
Exact Mass233.05
IUPAC Name1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine
SMILESCN(C)C(NN)c1ccc(Cl)cc1Cl
InChIInChI=1S/C9H13Cl2N3/c1-14(2)9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,13H,12H2,1-2H3
InChIKeyWBXVYKYNYWAGGG-UHFFFAOYSA-N
XLogP2.02
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.13
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1S)-1-(2,4-dichlorophenyl)ethanamine
CID 2496562
N-[1-(2,4-dichlorophenyl)ethyl]hydroxylamine
CID 16740749
1-(2,4-dichlorophenyl)ethanamine;ethane
CID 142953133
1,2-bis(2,4-dichlorophenyl)ethylhydrazine
CID 105295029
2-(2,4-dichlorophenyl)-N-methylpropanehydrazide
CID 116845828
1-(2,4-dichlorophenyl)heptylhydrazine
CID 105293920
1-amino-2-[1-(2,4-dichlorophenyl)ethyl]guanidine
CID 64869015
1-(2,4-dichlorophenyl)-2-(dimethylamino)ethanol
CID 15501082
[(2,4-dichlorophenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322333
[cyclohexyl-(2,4-dichlorophenyl)methyl]hydrazine
CID 105282000
N-[1-(2,4-dichlorophenyl)ethyl]-N-methylmethanesulfonamide
CID 60745550
1-(4-chloro-2-fluorophenyl)-N,N-dimethylethane-1,2-diamine
CID 114842824

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine?
The IUPAC name of 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine (CID 116914952) is 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine is CN(C)C(NN)c1ccc(Cl)cc1Cl.
What is the InChIKey of 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine?
The InChIKey is WBXVYKYNYWAGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13Cl2N3/c1-14(2)9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,13H,12H2,1-2H3.
What are the key properties of 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine?
1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine has a molecular weight of 234.13 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-1-hydrazinyl-N,N-dimethylmethanamine is sourced from PubChem (CID 116914952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).