[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine

C12H26N2S — CID 105300099

IUPAC[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
SMILESCC(C)(C)CCC(NN)C1(C)CCCS1
InChIInChI=1S/C12H26N2S/c1-11(2,3)8-6-10(14-13)12(4)7-5-9-15-12/h10,14H,5-9,13H2,1-4H3
InChIKeyFJCWMPNHCYHVSH-UHFFFAOYSA-N
MW230.42 g/mol
LogP2.93
Rot. Bonds4

About [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine

[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine (PubChem CID 105300099) has the molecular formula C12H26N2S and a molecular weight of 230.42 g/mol. Its IUPAC name is [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
PubChem CID105300099
Molecular FormulaC12H26N2S
Molecular Weight230.42 g/mol
Exact Mass230.18
IUPAC Name[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
SMILESCC(C)(C)CCC(NN)C1(C)CCCS1
InChIInChI=1S/C12H26N2S/c1-11(2,3)8-6-10(14-13)12(4)7-5-9-15-12/h10,14H,5-9,13H2,1-4H3
InChIKeyFJCWMPNHCYHVSH-UHFFFAOYSA-N
XLogP2.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 52.93
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

[4,4,4-Trifluoro-1-(2-methylthiolan-2-yl)butyl]hydrazine
CID 105313966
[5,5,5-Trifluoro-1-(2-methylthiolan-2-yl)pentyl]hydrazine
CID 105329037
[5,5,5-Trifluoro-1-(thiolan-3-yl)pentyl]hydrazine
CID 105329067
3-Propan-2-yl-5-(thiolan-2-yl)pyrazolidine
CID 130205089
2-(2,4,4-Trimethylpentan-2-yl)thiolane-3,4-diamine
CID 164099643
[1-(5,6-Dimethyl-1,4-dithian-2-yl)-4,4-dimethylpentyl]hydrazine
CID 103347183
4,4-Dimethyl-1-(2-methylthiolan-2-yl)pentan-1-amine
CID 105140036
4,4-Dimethyl-1-(thiolan-3-yl)pentan-1-amine
CID 105140141
(1-Cyclopentyl-2-methylsulfanylethyl)hydrazine
CID 105213796
(1-Cyclopentyl-3-methylsulfanylpropan-2-yl)hydrazine
CID 105213797
(4-Ethyl-1-methylsulfanyloctan-2-yl)hydrazine
CID 105213835
(1-Cycloheptyl-2-methylsulfanylethyl)hydrazine
CID 105213866

Frequently Asked Questions

What is the IUPAC name of [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine?
The IUPAC name of [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine (CID 105300099) is [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine.
What is the SMILES notation for [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine?
The canonical SMILES for [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine is CC(C)(C)CCC(NN)C1(C)CCCS1.
What is the InChIKey of [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine?
The InChIKey is FJCWMPNHCYHVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2S/c1-11(2,3)8-6-10(14-13)12(4)7-5-9-15-12/h10,14H,5-9,13H2,1-4H3.
What are the key properties of [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine?
[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine has a molecular weight of 230.42 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine is sourced from PubChem (CID 105300099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).