2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine

C7H11ClN2S — CID 83006847

IUPAC2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine
SMILESCN(C)NCc1cc(Cl)cs1
InChIInChI=1S/C7H11ClN2S/c1-10(2)9-4-7-3-6(8)5-11-7/h3,5,9H,4H2,1-2H3
InChIKeyRRVYQJVIECYSDX-UHFFFAOYSA-N
MW190.70 g/mol
LogP1.97
Rot. Bonds3

About 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine

2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine (PubChem CID 83006847) has the molecular formula C7H11ClN2S and a molecular weight of 190.70 g/mol. Its IUPAC name is 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine
PubChem CID83006847
Molecular FormulaC7H11ClN2S
Molecular Weight190.70 g/mol
Exact Mass190.03
IUPAC Name2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine
SMILESCN(C)NCc1cc(Cl)cs1
InChIInChI=1S/C7H11ClN2S/c1-10(2)9-4-7-3-6(8)5-11-7/h3,5,9H,4H2,1-2H3
InChIKeyRRVYQJVIECYSDX-UHFFFAOYSA-N
XLogP1.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.70
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-chlorothiophen-2-yl)methylamino]-N-ethyl-N-methylacetamide
CID 107166864
N-[(4-chlorothiophen-2-yl)methyl]prop-2-yn-1-amine
CID 79420548
(1R)-1-(4-chlorophenyl)-N-[(4-chlorothiophen-2-yl)methyl]ethanamine
CID 81352477
N-[(4-chlorothiophen-2-yl)methyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79426608
3-[2-[(4-chlorothiophen-2-yl)methylamino]ethyl]-1,1-dimethylurea
CID 83115789
N-[(4-chlorothiophen-2-yl)methyl]-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 107165869
N-[(4-chlorothiophen-2-yl)methyl]-2,4,4-trimethylpentan-2-amine
CID 79419724
2,4,6-trichloro-N-[(4-chlorothiophen-2-yl)methyl]aniline
CID 79420568
4-chloro-2-(chloromethyl)thiophene
CID 57161071
N-[(4-chlorothiophen-2-yl)methyl]-2,2-dimethoxyethanamine
CID 79419390
N'-[(4-chlorothiophen-2-yl)methyl]-N,N-dimethyl-1-thiophen-2-ylethane-1,2-diamine
CID 79420563
N'-[(4-chlorothiophen-2-yl)methyl]-N'-methylethane-1,2-diamine
CID 79427187

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine?
The IUPAC name of 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine (CID 83006847) is 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine.
What is the SMILES notation for 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine?
The canonical SMILES for 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine is CN(C)NCc1cc(Cl)cs1.
What is the InChIKey of 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine?
The InChIKey is RRVYQJVIECYSDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11ClN2S/c1-10(2)9-4-7-3-6(8)5-11-7/h3,5,9H,4H2,1-2H3.
What are the key properties of 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine?
2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine has a molecular weight of 190.70 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorothiophen-2-yl)methyl]-1,1-dimethylhydrazine is sourced from PubChem (CID 83006847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).