(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine

C16H22N2S — CID 105216322

IUPAC(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine
SMILESCC(C)(c1ccccc1)C(CCc1cccs1)NN
InChIInChI=1S/C16H22N2S/c1-16(2,13-7-4-3-5-8-13)15(18-17)11-10-14-9-6-12-19-14/h3-9,12,15,18H,10-11,17H2,1-2H3
InChIKeyIGULRPUDKGMFFU-UHFFFAOYSA-N
MW274.43 g/mol
LogP3.49
Rot. Bonds6

About (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine

(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine (PubChem CID 105216322) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine.

Molecular Properties

Compound Name(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine
PubChem CID105216322
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine
SMILESCC(C)(c1ccccc1)C(CCc1cccs1)NN
InChIInChI=1S/C16H22N2S/c1-16(2,13-7-4-3-5-8-13)15(18-17)11-10-14-9-6-12-19-14/h3-9,12,15,18H,10-11,17H2,1-2H3
InChIKeyIGULRPUDKGMFFU-UHFFFAOYSA-N
XLogP3.49
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 53.49
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-(1-(Thiophen-2-yl)cyclohexyl)ethanamine
CID 24860900
N-(2-phenylethyl)-1-thiophen-2-ylpentan-2-amine
CID 172449576
N-(2-phenylethyl)-1-thiophen-2-ylpentan-3-amine
CID 172457746
1-phenyl-N-(2-thiophen-2-ylethyl)pentan-2-amine
CID 172471278
3-(4-fluorophenyl)-4-methyl-5-thiophen-2-yl-2,3-dihydro-1H-pyrazole
CID 70019662
5-(4-Fluorophenyl)-3-thiophen-3-ylpentane-1,2-diamine
CID 91072645
5-(4-Fluorophenyl)-1-thiophen-3-ylpentane-2,3-diamine
CID 142832111
2-(4-Fluorophenyl)-2-methyl-3-thiophen-2-ylpropan-1-amine
CID 24268686
2-(3-Fluorophenyl)-2-methyl-3-thiophen-2-ylpropan-1-amine
CID 24268711
2-(2-Fluorophenyl)-2-methyl-3-thiophen-2-ylpropan-1-amine
CID 24268736
3-(2-Fluorophenyl)-2-methyl-2-thiophen-2-ylpropan-1-amine
CID 24268798
3-(4-Fluorophenyl)-2-methyl-2-thiophen-2-ylpropan-1-amine
CID 24268799

Frequently Asked Questions

What is the IUPAC name of (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine?
The IUPAC name of (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine (CID 105216322) is (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine.
What is the SMILES notation for (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine?
The canonical SMILES for (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine is CC(C)(c1ccccc1)C(CCc1cccs1)NN.
What is the InChIKey of (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine?
The InChIKey is IGULRPUDKGMFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-16(2,13-7-4-3-5-8-13)15(18-17)11-10-14-9-6-12-19-14/h3-9,12,15,18H,10-11,17H2,1-2H3.
What are the key properties of (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine?
(4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine has a molecular weight of 274.43 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-4-phenyl-1-thiophen-2-ylpentan-3-yl)hydrazine is sourced from PubChem (CID 105216322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).