2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

C10H14N2S — CID 115020034

IUPAC2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESC1Cc2nc(CC3CNC3)sc2C1
InChIInChI=1S/C10H14N2S/c1-2-8-9(3-1)13-10(12-8)4-7-5-11-6-7/h7,11H,1-6H2
InChIKeyVFBSJTHPIWQWGH-UHFFFAOYSA-N
MW194.30 g/mol
LogP1.39
Rot. Bonds2

About 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 115020034) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID115020034
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESC1Cc2nc(CC3CNC3)sc2C1
InChIInChI=1S/C10H14N2S/c1-2-8-9(3-1)13-10(12-8)4-7-5-11-6-7/h7,11H,1-6H2
InChIKeyVFBSJTHPIWQWGH-UHFFFAOYSA-N
XLogP1.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 58541380
2-(piperidin-2-ylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 115041792
2-propyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 130511936
4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethanamine
CID 3469612
2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanol
CID 83390528
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)-3-fluoropropan-1-amine
CID 115887949
2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine;dihydrochloride
CID 47000761
2-[(4-cyclopropylidenepiperidin-1-yl)methyl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 121184287
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)cyclohex-2-en-1-amine
CID 115887879
N-piperidin-3-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
CID 83839279
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)methanesulfonamide
CID 165441927
2-(azetidin-3-ylmethyl)-5-methyl-4-(2-methylpropyl)-1,3-thiazole
CID 105482444

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 115020034) is 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is C1Cc2nc(CC3CNC3)sc2C1.
What is the InChIKey of 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is VFBSJTHPIWQWGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2S/c1-2-8-9(3-1)13-10(12-8)4-7-5-11-6-7/h7,11H,1-6H2.
What are the key properties of 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 194.30 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 115020034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).