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

C15H24N2S — CID 64755999

IUPAC1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine
SMILESCNC1(c2nc3c(s2)CCC3)CC(C)CCC1C
InChIInChI=1S/C15H24N2S/c1-10-7-8-11(2)15(9-10,16-3)14-17-12-5-4-6-13(12)18-14/h10-11,16H,4-9H2,1-3H3
InChIKeyKARYBAQBMFTOGP-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.50
Rot. Bonds2

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

1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine (PubChem CID 64755999) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine
PubChem CID64755999
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine
SMILESCNC1(c2nc3c(s2)CCC3)CC(C)CCC1C
InChIInChI=1S/C15H24N2S/c1-10-7-8-11(2)15(9-10,16-3)14-17-12-5-4-6-13(12)18-14/h10-11,16H,4-9H2,1-3H3
InChIKeyKARYBAQBMFTOGP-UHFFFAOYSA-N
XLogP3.50
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine?
The IUPAC name of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine (CID 64755999) is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine is CNC1(c2nc3c(s2)CCC3)CC(C)CCC1C.
What is the InChIKey of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine?
The InChIKey is KARYBAQBMFTOGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-10-7-8-11(2)15(9-10,16-3)14-17-12-5-4-6-13(12)18-14/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine?
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N,2,5-trimethylcyclohexan-1-amine has a molecular weight of 264.44 g/mol, XLogP of 3.50, 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)-N,2,5-trimethylcyclohexan-1-amine is sourced from PubChem (CID 64755999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).