1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine

C13H20N2S — CID 103563881

IUPAC1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine
SMILESCC(C)C1CC(N)(c2nc3c(s2)CCC3)C1
InChIInChI=1S/C13H20N2S/c1-8(2)9-6-13(14,7-9)12-15-10-4-3-5-11(10)16-12/h8-9H,3-7,14H2,1-2H3
InChIKeyJPYHTZUBOYMGKX-UHFFFAOYSA-N
MW236.38 g/mol
LogP2.85
Rot. Bonds2

About 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine

1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine (PubChem CID 103563881) has the molecular formula C13H20N2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine.

Molecular Properties

Compound Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine
PubChem CID103563881
Molecular FormulaC13H20N2S
Molecular Weight236.38 g/mol
Exact Mass236.13
IUPAC Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine
SMILESCC(C)C1CC(N)(c2nc3c(s2)CCC3)C1
InChIInChI=1S/C13H20N2S/c1-8(2)9-6-13(14,7-9)12-15-10-4-3-5-11(10)16-12/h8-9H,3-7,14H2,1-2H3
InChIKeyJPYHTZUBOYMGKX-UHFFFAOYSA-N
XLogP2.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-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-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine?
The IUPAC name of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine (CID 103563881) is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine.
What is the SMILES notation for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine?
The canonical SMILES for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine is CC(C)C1CC(N)(c2nc3c(s2)CCC3)C1.
What is the InChIKey of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine?
The InChIKey is JPYHTZUBOYMGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2S/c1-8(2)9-6-13(14,7-9)12-15-10-4-3-5-11(10)16-12/h8-9H,3-7,14H2,1-2H3.
What are the key properties of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine?
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine has a molecular weight of 236.38 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-propan-2-ylcyclobutan-1-amine is sourced from PubChem (CID 103563881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).