1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine

C10H19N5O2S — CID 112751914

IUPAC1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine
SMILESCCCN1CCN(CCn2cc(N)cn2)S1(=O)=O
InChIInChI=1S/C10H19N5O2S/c1-2-3-14-6-7-15(18(14,16)17)5-4-13-9-10(11)8-12-13/h8-9H,2-7,11H2,1H3
InChIKeySSZZLVUBQGBCHG-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.26
Rot. Bonds5

About 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine

1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine (PubChem CID 112751914) has the molecular formula C10H19N5O2S and a molecular weight of 273.36 g/mol. Its IUPAC name is 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine
PubChem CID112751914
Molecular FormulaC10H19N5O2S
Molecular Weight273.36 g/mol
Exact Mass273.13
IUPAC Name1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine
SMILESCCCN1CCN(CCn2cc(N)cn2)S1(=O)=O
InChIInChI=1S/C10H19N5O2S/c1-2-3-14-6-7-15(18(14,16)17)5-4-13-9-10(11)8-12-13/h8-9H,2-7,11H2,1H3
InChIKeySSZZLVUBQGBCHG-UHFFFAOYSA-N
XLogP-0.26
TPSA84.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine (CID 112751914) is 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine is CCCN1CCN(CCn2cc(N)cn2)S1(=O)=O.
What is the InChIKey of 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine?
The InChIKey is SSZZLVUBQGBCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2S/c1-2-3-14-6-7-15(18(14,16)17)5-4-13-9-10(11)8-12-13/h8-9H,2-7,11H2,1H3.
What are the key properties of 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine?
1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine has a molecular weight of 273.36 g/mol, XLogP of -0.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,1-dioxo-5-propyl-1,2,5-thiadiazolidin-2-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 112751914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).