2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine

C11H10FN3S — CID 103494025

IUPAC2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine
SMILESNc1cnc(N2CCc3ccc(F)cc32)s1
InChIInChI=1S/C11H10FN3S/c12-8-2-1-7-3-4-15(9(7)5-8)11-14-6-10(13)16-11/h1-2,5-6H,3-4,13H2
InChIKeyHEIXLKKBSOBHAQ-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.56
Rot. Bonds1

About 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine

2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine (PubChem CID 103494025) has the molecular formula C11H10FN3S and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine
PubChem CID103494025
Molecular FormulaC11H10FN3S
Molecular Weight235.29 g/mol
Exact Mass235.06
IUPAC Name2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine
SMILESNc1cnc(N2CCc3ccc(F)cc32)s1
InChIInChI=1S/C11H10FN3S/c12-8-2-1-7-3-4-15(9(7)5-8)11-14-6-10(13)16-11/h1-2,5-6H,3-4,13H2
InChIKeyHEIXLKKBSOBHAQ-UHFFFAOYSA-N
XLogP2.56
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-Diphenyl-1,3-thiazol-2-amine
CID 619921
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 71657337
5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 25093334
5-bromo-N-(2-methylphenyl)-1,3-thiazol-2-amine
CID 16068848
N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 655793
N-(4-fluorophenyl)-5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-amine
CID 741082
2-pyrrolidin-1-yl-N-[2-(trifluoromethyl)phenyl]-1,3-thiazole-5-carbothioamide
CID 2100715
5-(4-fluorobenzyl)-N-phenyl-1,3-thiazol-2-amine
CID 2130702
N-(4-fluorophenyl)-N-[(3S)-pyrrolidin-3-yl]-1,3-thiazol-2-amine
CID 15604518
N-(3-fluorophenyl)-N'-(1,3-thiazol-2-yl)pyrrolidine-1-carboximidamide
CID 20488350
4-Fluoro-2-(1,3-thiazol-2-ylamino)benzonitrile
CID 21069919
N-(2-(aminomethyl)-5-fluorophenyl)thiazol-2-amine
CID 21069987

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine?
The IUPAC name of 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine (CID 103494025) is 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine is Nc1cnc(N2CCc3ccc(F)cc32)s1.
What is the InChIKey of 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine?
The InChIKey is HEIXLKKBSOBHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3S/c12-8-2-1-7-3-4-15(9(7)5-8)11-14-6-10(13)16-11/h1-2,5-6H,3-4,13H2.
What are the key properties of 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine?
2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine has a molecular weight of 235.29 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-2,3-dihydroindol-1-yl)-1,3-thiazol-5-amine is sourced from PubChem (CID 103494025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).