1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine

C13H14N2S — CID 62652857

IUPAC1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine
SMILESCC(N)Cc1nc2c(s1)Cc1ccccc1-2
InChIInChI=1S/C13H14N2S/c1-8(14)6-12-15-13-10-5-3-2-4-9(10)7-11(13)16-12/h2-5,8H,6-7,14H2,1H3
InChIKeyVXMIQKFTWZELHS-UHFFFAOYSA-N
MW230.34 g/mol
LogP2.60
Rot. Bonds2

About 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine

1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine (PubChem CID 62652857) has the molecular formula C13H14N2S and a molecular weight of 230.34 g/mol. Its IUPAC name is 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine
PubChem CID62652857
Molecular FormulaC13H14N2S
Molecular Weight230.34 g/mol
Exact Mass230.09
IUPAC Name1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine
SMILESCC(N)Cc1nc2c(s1)Cc1ccccc1-2
InChIInChI=1S/C13H14N2S/c1-8(14)6-12-15-13-10-5-3-2-4-9(10)7-11(13)16-12/h2-5,8H,6-7,14H2,1H3
InChIKeyVXMIQKFTWZELHS-UHFFFAOYSA-N
XLogP2.60
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.34
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-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-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine?
The IUPAC name of 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine (CID 62652857) is 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine.
What is the SMILES notation for 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine?
The canonical SMILES for 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine is CC(N)Cc1nc2c(s1)Cc1ccccc1-2.
What is the InChIKey of 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine?
The InChIKey is VXMIQKFTWZELHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2S/c1-8(14)6-12-15-13-10-5-3-2-4-9(10)7-11(13)16-12/h2-5,8H,6-7,14H2,1H3.
What are the key properties of 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine?
1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine has a molecular weight of 230.34 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4H-indeno[1,2-d][1,3]thiazol-2-yl)propan-2-amine is sourced from PubChem (CID 62652857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).