2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine

C8H10F2N2S — CID 105456188

IUPAC2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine
SMILESNCCc1nc2c(s1)C(F)(F)CC2
InChIInChI=1S/C8H10F2N2S/c9-8(10)3-1-5-7(8)13-6(12-5)2-4-11/h1-4,11H2
InChIKeyMWKGVHFFKNGGOM-UHFFFAOYSA-N
MW204.24 g/mol
LogP1.68
Rot. Bonds2

About 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine

2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine (PubChem CID 105456188) has the molecular formula C8H10F2N2S and a molecular weight of 204.24 g/mol. Its IUPAC name is 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine
PubChem CID105456188
Molecular FormulaC8H10F2N2S
Molecular Weight204.24 g/mol
Exact Mass204.05
IUPAC Name2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine
SMILESNCCc1nc2c(s1)C(F)(F)CC2
InChIInChI=1S/C8H10F2N2S/c9-8(10)3-1-5-7(8)13-6(12-5)2-4-11/h1-4,11H2
InChIKeyMWKGVHFFKNGGOM-UHFFFAOYSA-N
XLogP1.68
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4H,5H,6H-cyclopenta(d)(1,3)thiazole
CID 21529489
5,6-Dihydro-2-(3-piperidinyl)-4H-cyclopentathiazole
CID 24261809
4-(4H,5H,6H-cyclopenta(d)(1,3)thiazol-2-yl)piperidine
CID 24261830
4-((4H,5H,6H-cyclopenta(d)(1,3)thiazol-2-yl)methyl)piperidine
CID 24262114
2-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}ethan-1-amine
CID 73012450
4-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}piperidine hydrochloride
CID 177800580
1-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}ethan-1-amine
CID 24261659
4-fluoro-2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 89140365
2-(Difluoromethyl)spiro[4,6-dihydrocyclopenta[d][1,3]thiazole-5,4'-piperidine]
CID 167048093
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethanamine
CID 24274467
2-[4-Methyl-2-(trifluoromethyl)-1,3-thiazol-5-yl]ethanamine
CID 46835628
1-[4-Methyl-2-(2,2,2-trifluoroethyl)-1,3-thiazol-5-yl]ethanamine
CID 61392802

Frequently Asked Questions

What is the IUPAC name of 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine?
The IUPAC name of 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine (CID 105456188) is 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine.
What is the SMILES notation for 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine?
The canonical SMILES for 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine is NCCc1nc2c(s1)C(F)(F)CC2.
What is the InChIKey of 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine?
The InChIKey is MWKGVHFFKNGGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2S/c9-8(10)3-1-5-7(8)13-6(12-5)2-4-11/h1-4,11H2.
What are the key properties of 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine?
2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine has a molecular weight of 204.24 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,6-difluoro-4,5-dihydrocyclopenta[d][1,3]thiazol-2-yl)ethanamine is sourced from PubChem (CID 105456188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).