2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine

C9H17N3S — CID 105244702

IUPAC2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine
SMILESCc1ccc(C(CN(C)C)NN)s1
InChIInChI=1S/C9H17N3S/c1-7-4-5-9(13-7)8(11-10)6-12(2)3/h4-5,8,11H,6,10H2,1-3H3
InChIKeyASCUHKWEVZPLHW-UHFFFAOYSA-N
MW199.32 g/mol
LogP1.12
Rot. Bonds4

About 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine

2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine (PubChem CID 105244702) has the molecular formula C9H17N3S and a molecular weight of 199.32 g/mol. Its IUPAC name is 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine
PubChem CID105244702
Molecular FormulaC9H17N3S
Molecular Weight199.32 g/mol
Exact Mass199.11
IUPAC Name2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine
SMILESCc1ccc(C(CN(C)C)NN)s1
InChIInChI=1S/C9H17N3S/c1-7-4-5-9(13-7)8(11-10)6-12(2)3/h4-5,8,11H,6,10H2,1-3H3
InChIKeyASCUHKWEVZPLHW-UHFFFAOYSA-N
XLogP1.12
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine?
The IUPAC name of 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine (CID 105244702) is 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine is Cc1ccc(C(CN(C)C)NN)s1.
What is the InChIKey of 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine?
The InChIKey is ASCUHKWEVZPLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3S/c1-7-4-5-9(13-7)8(11-10)6-12(2)3/h4-5,8,11H,6,10H2,1-3H3.
What are the key properties of 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine?
2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine has a molecular weight of 199.32 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N,N-dimethyl-2-(5-methylthiophen-2-yl)ethanamine is sourced from PubChem (CID 105244702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).