[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine

C11H14Cl2N2S — CID 105301765

IUPAC[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1cccc(Cl)c1Cl)C1CCSC1
InChIInChI=1S/C11H14Cl2N2S/c12-9-3-1-2-8(10(9)13)11(15-14)7-4-5-16-6-7/h1-3,7,11,15H,4-6,14H2
InChIKeyMJGVVOPQXKUSJW-UHFFFAOYSA-N
MW277.22 g/mol
LogP3.25
Rot. Bonds3

About [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine

[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine (PubChem CID 105301765) has the molecular formula C11H14Cl2N2S and a molecular weight of 277.22 g/mol. Its IUPAC name is [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine
PubChem CID105301765
Molecular FormulaC11H14Cl2N2S
Molecular Weight277.22 g/mol
Exact Mass276.03
IUPAC Name[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1cccc(Cl)c1Cl)C1CCSC1
InChIInChI=1S/C11H14Cl2N2S/c12-9-3-1-2-8(10(9)13)11(15-14)7-4-5-16-6-7/h1-3,7,11,15H,4-6,14H2
InChIKeyMJGVVOPQXKUSJW-UHFFFAOYSA-N
XLogP3.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.22
LogP ≤ 53.25
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

[(4-tert-butylcyclohexyl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 105232732
[(2,3-dichlorophenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232276
[(2,3-dichlorophenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 105312173
[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
CID 105327009
[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105281249
[2-(2,6-dichlorophenyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105293205
cyclopropyl-(2,3-dichlorophenyl)methanamine
CID 62789310
[(2-chlorophenyl)-cyclopentylmethyl]hydrazine
CID 91756387
[(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105320870
[(2-chlorophenyl)-(1,4-dithian-2-yl)methyl]hydrazine
CID 105249146
[(2,3-dichlorophenyl)-(2,2-dimethylcyclopentyl)methyl]hydrazine
CID 107193772
[(2,3-dichlorophenyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 105301714

Frequently Asked Questions

What is the IUPAC name of [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The IUPAC name of [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine (CID 105301765) is [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine is NNC(c1cccc(Cl)c1Cl)C1CCSC1.
What is the InChIKey of [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The InChIKey is MJGVVOPQXKUSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2S/c12-9-3-1-2-8(10(9)13)11(15-14)7-4-5-16-6-7/h1-3,7,11,15H,4-6,14H2.
What are the key properties of [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine has a molecular weight of 277.22 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105301765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).