2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

C8H11NS — CID 58541380

IUPAC2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2
InChIInChI=1S/C8H11NS/c1-2-8-9-6-4-3-5-7(6)10-8/h2-5H2,1H3
InChIKeyBEDFYAWIFLERQK-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.19
Rot. Bonds1

About 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 58541380) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID58541380
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2
InChIInChI=1S/C8H11NS/c1-2-8-9-6-4-3-5-7(6)10-8/h2-5H2,1H3
InChIKeyBEDFYAWIFLERQK-UHFFFAOYSA-N
XLogP2.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-propyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 130511936
2-ethyl-5,6-dihydro-4H-1,3-benzothiazol-7-one
CID 62079122
4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethanamine
CID 3469612
1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butan-2-amine
CID 62646241
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)hexan-1-amine
CID 115887221
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)methanesulfonamide
CID 165441927
2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanol
CID 83390528
ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate
CID 110460548
4-ethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)aniline
CID 94282044
2-(4,5,6,7,8,9-hexahydrocycloocta[d][1,3]thiazol-2-yl)-N-methylethanamine
CID 4223788
2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 115020034
2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine;dihydrochloride
CID 47000761

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 58541380) is 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is CCc1nc2c(s1)CCC2.
What is the InChIKey of 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is BEDFYAWIFLERQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-2-8-9-6-4-3-5-7(6)10-8/h2-5H2,1H3.
What are the key properties of 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 153.25 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 58541380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).