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

C15H24N2S — CID 61334100

IUPACN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine
SMILESCC(C)CC(C)(NC1CC1)c1nc2c(s1)CCC2
InChIInChI=1S/C15H24N2S/c1-10(2)9-15(3,17-11-7-8-11)14-16-12-5-4-6-13(12)18-14/h10-11,17H,4-9H2,1-3H3
InChIKeyQLCCRONISHTTAP-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.65
Rot. Bonds5

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

N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine (PubChem CID 61334100) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine
PubChem CID61334100
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine
SMILESCC(C)CC(C)(NC1CC1)c1nc2c(s1)CCC2
InChIInChI=1S/C15H24N2S/c1-10(2)9-15(3,17-11-7-8-11)14-16-12-5-4-6-13(12)18-14/h10-11,17H,4-9H2,1-3H3
InChIKeyQLCCRONISHTTAP-UHFFFAOYSA-N
XLogP3.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine?
The IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine (CID 61334100) is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine.
What is the SMILES notation for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine?
The canonical SMILES for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine is CC(C)CC(C)(NC1CC1)c1nc2c(s1)CCC2.
What is the InChIKey of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine?
The InChIKey is QLCCRONISHTTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-10(2)9-15(3,17-11-7-8-11)14-16-12-5-4-6-13(12)18-14/h10-11,17H,4-9H2,1-3H3.
What are the key properties of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine?
N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine has a molecular weight of 264.44 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpentan-2-yl]cyclopropanamine is sourced from PubChem (CID 61334100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).