5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine

C12H12N4S — CID 44570389

IUPAC5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine
SMILESCc1nc(C)c(-c2ccc3[nH]nc(N)c3c2)s1
InChIInChI=1S/C12H12N4S/c1-6-11(17-7(2)14-6)8-3-4-10-9(5-8)12(13)16-15-10/h3-5H,1-2H3,(H3,13,15,16)
InChIKeyBLSFBFJSSNCFOX-UHFFFAOYSA-N
MW244.32 g/mol
LogP2.89
Rot. Bonds1

About 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine

5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine (PubChem CID 44570389) has the molecular formula C12H12N4S and a molecular weight of 244.32 g/mol. Its IUPAC name is 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine
PubChem CID44570389
Molecular FormulaC12H12N4S
Molecular Weight244.32 g/mol
Exact Mass244.08
IUPAC Name5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine
SMILESCc1nc(C)c(-c2ccc3[nH]nc(N)c3c2)s1
InChIInChI=1S/C12H12N4S/c1-6-11(17-7(2)14-6)8-3-4-10-9(5-8)12(13)16-15-10/h3-5H,1-2H3,(H3,13,15,16)
InChIKeyBLSFBFJSSNCFOX-UHFFFAOYSA-N
XLogP2.89
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1H-indazol-5-yl)-2-methylthiazole
CID 25167076
4-(1H-indazol-5-yl)thiazol-2-amine
CID 25167079
4-Benzothiazol-2-YL-5-(3-methylamino-propyl)-2H-pyrazol-3-ylamine
CID 66768141
US8754233, 4-Benzothiazol-2-yl-1H-pyrazole-3,5-diamine
CID 15651033
US8754233, 4-Benzothiazol-2-yl-5-ethyl-1H-pyrazol-3-ylamine
CID 28285639
US8754233, 4-Benzothiazol-2-yl-5-phenyl-1H-pyrazol-3-ylamine
CID 28285645
US8754233, 4-Benzothiazol-2-yl-5-cyclopropyl-2H-pyrazol-3-ylamine
CID 28285652
US8754233, 4-Benzothiazol-2-yl-5-thiophen-2-yl-2H-pyrazol-3-ylamine
CID 28285658
US8754233, 4-Benzothiazol-2-yl-5-methyl-1H-pyrazol-3-ylamine
CID 28286160
3-(3-aminopropyl)-4-(1,3-benzothiazol-2-yl)-1H-pyrazol-5-amine
CID 39869478
5-Methyl-4-(6-pyrrolidin-1-ylmethyl-benzothiazol-2-YL)-2H-pyrazol-3-ylamine
CID 66766599
4-(4-fluorobenzothiazol-2-yl)-5-methyl-2H-pyrazol-3-ylamine
CID 66767963

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine?
The IUPAC name of 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine (CID 44570389) is 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine.
What is the SMILES notation for 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine?
The canonical SMILES for 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine is Cc1nc(C)c(-c2ccc3[nH]nc(N)c3c2)s1.
What is the InChIKey of 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine?
The InChIKey is BLSFBFJSSNCFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4S/c1-6-11(17-7(2)14-6)8-3-4-10-9(5-8)12(13)16-15-10/h3-5H,1-2H3,(H3,13,15,16).
What are the key properties of 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine?
5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine has a molecular weight of 244.32 g/mol, XLogP of 2.89, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazol-3-amine is sourced from PubChem (CID 44570389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).