1-(2-methylthiolan-2-yl)prop-2-enylhydrazine

C8H16N2S — CID 105318107

IUPAC1-(2-methylthiolan-2-yl)prop-2-enylhydrazine
SMILESC=CC(NN)C1(C)CCCS1
InChIInChI=1S/C8H16N2S/c1-3-7(10-9)8(2)5-4-6-11-8/h3,7,10H,1,4-6,9H2,2H3
InChIKeyAYZQRCKFWNAKCO-UHFFFAOYSA-N
MW172.30 g/mol
LogP1.29
Rot. Bonds3

About 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine

1-(2-methylthiolan-2-yl)prop-2-enylhydrazine (PubChem CID 105318107) has the molecular formula C8H16N2S and a molecular weight of 172.30 g/mol. Its IUPAC name is 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine.

Molecular Properties

Compound Name1-(2-methylthiolan-2-yl)prop-2-enylhydrazine
PubChem CID105318107
Molecular FormulaC8H16N2S
Molecular Weight172.30 g/mol
Exact Mass172.10
IUPAC Name1-(2-methylthiolan-2-yl)prop-2-enylhydrazine
SMILESC=CC(NN)C1(C)CCCS1
InChIInChI=1S/C8H16N2S/c1-3-7(10-9)8(2)5-4-6-11-8/h3,7,10H,1,4-6,9H2,2H3
InChIKeyAYZQRCKFWNAKCO-UHFFFAOYSA-N
XLogP1.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.30
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-methyl-1-(2-methylthiolan-2-yl)propyl]hydrazine
CID 105281773
1-(1-methylcyclohexyl)prop-2-enylhydrazine
CID 106831272
1-(2-methylthiolan-2-yl)oct-7-enylhydrazine
CID 107013114
1-(2-methylthiolan-2-yl)prop-2-ynylhydrazine
CID 105315651
[3-methylidene-1-(2-methylthiolan-2-yl)pentyl]hydrazine
CID 105320436
[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
CID 105300099
[2-methyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
CID 107895936
[3-cyclopropyl-1-(2-methylthiolan-2-yl)propyl]hydrazine
CID 105315206
[3,4-dihydro-2H-pyran-5-yl-(2-methylthiolan-2-yl)methyl]hydrazine
CID 105333259
[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine
CID 105341728
[(2-methylthiolan-2-yl)-thiophen-3-ylmethyl]hydrazine
CID 105312067
2-amino-1-(2-methylthiolan-2-yl)ethanol
CID 115012704

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine?
The IUPAC name of 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine (CID 105318107) is 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine.
What is the SMILES notation for 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine?
The canonical SMILES for 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine is C=CC(NN)C1(C)CCCS1.
What is the InChIKey of 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine?
The InChIKey is AYZQRCKFWNAKCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2S/c1-3-7(10-9)8(2)5-4-6-11-8/h3,7,10H,1,4-6,9H2,2H3.
What are the key properties of 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine?
1-(2-methylthiolan-2-yl)prop-2-enylhydrazine has a molecular weight of 172.30 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylthiolan-2-yl)prop-2-enylhydrazine is sourced from PubChem (CID 105318107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).