2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine

C14H14F2N2S — CID 55234728

IUPAC2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine
SMILESNc1sc(C2CCCC2)nc1-c1cccc(F)c1F
InChIInChI=1S/C14H14F2N2S/c15-10-7-3-6-9(11(10)16)12-13(17)19-14(18-12)8-4-1-2-5-8/h3,6-8H,1-2,4-5,17H2
InChIKeyXTSUYDTZUWETGF-UHFFFAOYSA-N
MW280.34 g/mol
LogP4.33
Rot. Bonds2

About 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine

2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine (PubChem CID 55234728) has the molecular formula C14H14F2N2S and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine
PubChem CID55234728
Molecular FormulaC14H14F2N2S
Molecular Weight280.34 g/mol
Exact Mass280.08
IUPAC Name2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine
SMILESNc1sc(C2CCCC2)nc1-c1cccc(F)c1F
InChIInChI=1S/C14H14F2N2S/c15-10-7-3-6-9(11(10)16)12-13(17)19-14(18-12)8-4-1-2-5-8/h3,6-8H,1-2,4-5,17H2
InChIKeyXTSUYDTZUWETGF-UHFFFAOYSA-N
XLogP4.33
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Phenyl-1,3-thiazol-2-yl)ethanethioamide
CID 724012
(2-Phenyl-1,3-thiazol-4-yl)methanamine
CID 736526
2-(2,3-Difluorophenyl)-4-phenyl-1,3-thiazole
CID 71459803
(5-Methyl-4-phenyl-1,3-thiazol-2-yl)methanamine
CID 3506452
4-Phenyl-1,3-thiazol-5-amine
CID 47002767
4-(4-Fluorophenyl)-2-methylthiazole
CID 731894
(3,4-Difluorophenyl)-[4-(3,5-difluorophenyl)-1,3-thiazol-2-yl]methanamine
CID 49789339
N-(2,4-Diphenylthiazole-5-yl)-2,2,2-trifluoroacetamide
CID 11631624
4-(3,4-Difluorophenyl)-2-methyl-1,3-thiazole
CID 2800028
(4-(2-Fluorophenyl)-1,3-thiazol-2-yl)methanamine
CID 4011780
[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]methanamine
CID 5026742
4-(4-(4-Fluorophenyl)-1,3-Thiazol-2-Yl)Aniline
CID 24261902

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine (CID 55234728) is 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine is Nc1sc(C2CCCC2)nc1-c1cccc(F)c1F.
What is the InChIKey of 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine?
The InChIKey is XTSUYDTZUWETGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2S/c15-10-7-3-6-9(11(10)16)12-13(17)19-14(18-12)8-4-1-2-5-8/h3,6-8H,1-2,4-5,17H2.
What are the key properties of 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine?
2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine has a molecular weight of 280.34 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-4-(2,3-difluorophenyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 55234728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).