[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine

C17H22N2S — CID 105341956

IUPAC[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
SMILESCc1cc(C(NN)c2cccc(C3CCC3)c2)sc1C
InChIInChI=1S/C17H22N2S/c1-11-9-16(20-12(11)2)17(19-18)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-10,13,17,19H,3,5-6,18H2,1-2H3
InChIKeyUSURPVLXIUEBAG-UHFFFAOYSA-N
MW286.44 g/mol
LogP4.19
Rot. Bonds4

About [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine

[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine (PubChem CID 105341956) has the molecular formula C17H22N2S and a molecular weight of 286.44 g/mol. Its IUPAC name is [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
PubChem CID105341956
Molecular FormulaC17H22N2S
Molecular Weight286.44 g/mol
Exact Mass286.15
IUPAC Name[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
SMILESCc1cc(C(NN)c2cccc(C3CCC3)c2)sc1C
InChIInChI=1S/C17H22N2S/c1-11-9-16(20-12(11)2)17(19-18)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-10,13,17,19H,3,5-6,18H2,1-2H3
InChIKeyUSURPVLXIUEBAG-UHFFFAOYSA-N
XLogP4.19
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.44
LogP ≤ 54.19
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

(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methanamine
CID 105053790
[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
CID 105342056
[(3-cyclobutylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105342013
[(3-cyclobutylphenyl)-(2,6-dimethyl-3-pyridinyl)methyl]hydrazine
CID 105341962
[(3-cyclobutylphenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279785
[(3-bromo-2-methylphenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342034
N-[(4-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]ethanamine
CID 105044884
[(3-cyclobutylphenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105342036
[(3-chloro-4-methylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
CID 107562559
1-(3-cyclobutylphenyl)propylhydrazine
CID 105200963
[(4-bromo-3-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342018
(5-bromo-4-methylthiophen-2-yl)-(3-cyclobutylphenyl)methanol
CID 115839009

Frequently Asked Questions

What is the IUPAC name of [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine (CID 105341956) is [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine is Cc1cc(C(NN)c2cccc(C3CCC3)c2)sc1C.
What is the InChIKey of [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine?
The InChIKey is USURPVLXIUEBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2S/c1-11-9-16(20-12(11)2)17(19-18)15-8-4-7-14(10-15)13-5-3-6-13/h4,7-10,13,17,19H,3,5-6,18H2,1-2H3.
What are the key properties of [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine?
[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine has a molecular weight of 286.44 g/mol, XLogP of 4.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105341956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).