[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine

C14H17ClN2S — CID 106868502

IUPAC[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
SMILESCc1ccc(CC(Cc2cccs2)NN)c(Cl)c1
InChIInChI=1S/C14H17ClN2S/c1-10-4-5-11(14(15)7-10)8-12(17-16)9-13-3-2-6-18-13/h2-7,12,17H,8-9,16H2,1H3
InChIKeyXWVYVZBKWSREPO-UHFFFAOYSA-N
MW280.82 g/mol
LogP3.33
Rot. Bonds5

About [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine

[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine (PubChem CID 106868502) has the molecular formula C14H17ClN2S and a molecular weight of 280.82 g/mol. Its IUPAC name is [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
PubChem CID106868502
Molecular FormulaC14H17ClN2S
Molecular Weight280.82 g/mol
Exact Mass280.08
IUPAC Name[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
SMILESCc1ccc(CC(Cc2cccs2)NN)c(Cl)c1
InChIInChI=1S/C14H17ClN2S/c1-10-4-5-11(14(15)7-10)8-12(17-16)9-13-3-2-6-18-13/h2-7,12,17H,8-9,16H2,1H3
InChIKeyXWVYVZBKWSREPO-UHFFFAOYSA-N
XLogP3.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.82
LogP ≤ 53.33
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

[1-(2-chloro-4-methylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 106859801
[1-(4-chloro-2-fluorophenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 105211872
[1-(4-fluoro-2-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 105211952
1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine
CID 106868414
[1-(5-chloro-2-fluorophenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 103053551
[1-(4-bromo-2-chlorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
CID 105335240
[1-(2-chloro-4-methylphenyl)-4-methoxybutan-2-yl]hydrazine
CID 106868463
[1-(2-chloro-4-methylphenyl)-4,5,5-trimethylhexan-2-yl]hydrazine
CID 106868573
[1-(2-chloro-4-methylphenyl)-3-pyridin-3-ylpropan-2-yl]hydrazine
CID 106868440
[1-(4-bromo-2-chlorophenyl)-3-(2,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105335288
4-(2-chloro-4-methylphenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 106871466
[1-(3-chloro-4-fluorophenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 103043829

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine?
The IUPAC name of [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine (CID 106868502) is [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine is Cc1ccc(CC(Cc2cccs2)NN)c(Cl)c1.
What is the InChIKey of [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine?
The InChIKey is XWVYVZBKWSREPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2S/c1-10-4-5-11(14(15)7-10)8-12(17-16)9-13-3-2-6-18-13/h2-7,12,17H,8-9,16H2,1H3.
What are the key properties of [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine?
[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine has a molecular weight of 280.82 g/mol, XLogP of 3.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine is sourced from PubChem (CID 106868502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).