N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine

C10H9N5S — CID 43731041

IUPACN-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine
SMILESc1cc(NCc2csnn2)c2[nH]ncc2c1
InChIInChI=1S/C10H9N5S/c1-2-7-4-12-14-10(7)9(3-1)11-5-8-6-16-15-13-8/h1-4,6,11H,5H2,(H,12,14)
InChIKeyYNJPUHXWPBXOPD-UHFFFAOYSA-N
MW231.28 g/mol
LogP2.03
Rot. Bonds3

About N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine

N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine (PubChem CID 43731041) has the molecular formula C10H9N5S and a molecular weight of 231.28 g/mol. Its IUPAC name is N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine.

Molecular Properties

Compound NameN-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine
PubChem CID43731041
Molecular FormulaC10H9N5S
Molecular Weight231.28 g/mol
Exact Mass231.06
IUPAC NameN-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine
SMILESc1cc(NCc2csnn2)c2[nH]ncc2c1
InChIInChI=1S/C10H9N5S/c1-2-7-4-12-14-10(7)9(3-1)11-5-8-6-16-15-13-8/h1-4,6,11H,5H2,(H,12,14)
InChIKeyYNJPUHXWPBXOPD-UHFFFAOYSA-N
XLogP2.03
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(thiadiazol-4-ylmethyl)-1H-indazol-7-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 N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine?
The IUPAC name of N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine (CID 43731041) is N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine.
What is the SMILES notation for N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine?
The canonical SMILES for N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine is c1cc(NCc2csnn2)c2[nH]ncc2c1.
What is the InChIKey of N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine?
The InChIKey is YNJPUHXWPBXOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5S/c1-2-7-4-12-14-10(7)9(3-1)11-5-8-6-16-15-13-8/h1-4,6,11H,5H2,(H,12,14).
What are the key properties of N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine?
N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine has a molecular weight of 231.28 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine is sourced from PubChem (CID 43731041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).