2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole

C15H15N3S — CID 116965326

IUPAC2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole
SMILESCc1[nH]c2ccccc2c1-c1csc(C2CNC2)n1
InChIInChI=1S/C15H15N3S/c1-9-14(11-4-2-3-5-12(11)17-9)13-8-19-15(18-13)10-6-16-7-10/h2-5,8,10,16-17H,6-7H2,1H3
InChIKeyYFOSGCNUZUBODM-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.29
Rot. Bonds2

About 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole

2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole (PubChem CID 116965326) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole
PubChem CID116965326
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC Name2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole
SMILESCc1[nH]c2ccccc2c1-c1csc(C2CNC2)n1
InChIInChI=1S/C15H15N3S/c1-9-14(11-4-2-3-5-12(11)17-9)13-8-19-15(18-13)10-6-16-7-10/h2-5,8,10,16-17H,6-7H2,1H3
InChIKeyYFOSGCNUZUBODM-UHFFFAOYSA-N
XLogP3.29
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-amine;hydrobromide
CID 166058003
4-(2-methyl-1H-indol-3-yl)-2-thiophen-3-yl-1,3-thiazole
CID 52517778
[2-(2-methyl-1H-indol-3-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892094
2-[[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]methyl]guanidine
CID 15636972
2-(azetidin-3-yl)-4-(2,5-dimethylphenyl)-1,3-thiazole
CID 116965302
4-(2-methyl-1H-indol-3-yl)pyrimidin-2-amine
CID 67553522
3,3-dimethyl-N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]butanamide
CID 75401712
2,6-difluoro-N-[(2S)-3-methyl-1-[[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]amino]-1-oxobutan-2-yl]benzamide
CID 24568899
[4-(2-methyl-1H-indol-3-yl)pyrimidin-2-yl]hydrazine
CID 116904148
[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine
CID 82292200
4-(2,6-difluorophenyl)-2-piperidin-4-yl-1,3-thiazole
CID 55084480
1-(benzenesulfonyl)-N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 26177013

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole?
The IUPAC name of 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole (CID 116965326) is 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole.
What is the SMILES notation for 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole?
The canonical SMILES for 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole is Cc1[nH]c2ccccc2c1-c1csc(C2CNC2)n1.
What is the InChIKey of 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole?
The InChIKey is YFOSGCNUZUBODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-9-14(11-4-2-3-5-12(11)17-9)13-8-19-15(18-13)10-6-16-7-10/h2-5,8,10,16-17H,6-7H2,1H3.
What are the key properties of 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole?
2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole has a molecular weight of 269.37 g/mol, XLogP of 3.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-4-(2-methyl-1H-indol-3-yl)-1,3-thiazole is sourced from PubChem (CID 116965326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).