N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine

C8H9N3OS — CID 107649624

IUPACN-[1-(furan-3-yl)ethyl]thiadiazol-5-amine
SMILESCC(Nc1cnns1)c1ccoc1
InChIInChI=1S/C8H9N3OS/c1-6(7-2-3-12-5-7)10-8-4-9-11-13-8/h2-6,10H,1H3
InChIKeyUBKHQXFNZCNZRF-UHFFFAOYSA-N
MW195.25 g/mol
LogP2.30
Rot. Bonds3

About N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine

N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine (PubChem CID 107649624) has the molecular formula C8H9N3OS and a molecular weight of 195.25 g/mol. Its IUPAC name is N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine.

Molecular Properties

Compound NameN-[1-(furan-3-yl)ethyl]thiadiazol-5-amine
PubChem CID107649624
Molecular FormulaC8H9N3OS
Molecular Weight195.25 g/mol
Exact Mass195.05
IUPAC NameN-[1-(furan-3-yl)ethyl]thiadiazol-5-amine
SMILESCC(Nc1cnns1)c1ccoc1
InChIInChI=1S/C8H9N3OS/c1-6(7-2-3-12-5-7)10-8-4-9-11-13-8/h2-6,10H,1H3
InChIKeyUBKHQXFNZCNZRF-UHFFFAOYSA-N
XLogP2.30
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine?
The IUPAC name of N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine (CID 107649624) is N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine.
What is the SMILES notation for N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine?
The canonical SMILES for N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine is CC(Nc1cnns1)c1ccoc1.
What is the InChIKey of N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine?
The InChIKey is UBKHQXFNZCNZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3OS/c1-6(7-2-3-12-5-7)10-8-4-9-11-13-8/h2-6,10H,1H3.
What are the key properties of N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine?
N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine has a molecular weight of 195.25 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-3-yl)ethyl]thiadiazol-5-amine is sourced from PubChem (CID 107649624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).