[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite

C10H13FN2OS — CID 155571475

IUPAC[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite
SMILESFSn1cnc(C2CCOC2)c1C1CC1
InChIInChI=1S/C10H13FN2OS/c11-15-13-6-12-9(8-3-4-14-5-8)10(13)7-1-2-7/h6-8H,1-5H2
InChIKeyJQLHLCQMLLJUFN-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.65
Rot. Bonds3

About [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite

[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite (PubChem CID 155571475) has the molecular formula C10H13FN2OS and a molecular weight of 228.29 g/mol. Its IUPAC name is [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite.

Molecular Properties

Compound Name[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite
PubChem CID155571475
Molecular FormulaC10H13FN2OS
Molecular Weight228.29 g/mol
Exact Mass228.07
IUPAC Name[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite
SMILESFSn1cnc(C2CCOC2)c1C1CC1
InChIInChI=1S/C10H13FN2OS/c11-15-13-6-12-9(8-3-4-14-5-8)10(13)7-1-2-7/h6-8H,1-5H2
InChIKeyJQLHLCQMLLJUFN-UHFFFAOYSA-N
XLogP2.65
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl]methyl]-1,3-dimethylbenzimidazol-2-one
CID 155460685
2-(oxolan-3-yl)pyridine-3,4-diamine
CID 129239595
5-[[4-cyclopropyl-5-(oxolan-3-yl)imidazol-1-yl]methyl]-1,3-dimethylbenzimidazol-2-one
CID 155460686
2-(oxolan-3-yl)-1,5-naphthyridin-3-amine
CID 169088323
7-fluoro-3-methyl-2-(oxolan-3-yl)imidazo[1,2-a]pyridine
CID 71251291
4-chloro-6-cyclopropyl-2-(oxolan-3-yl)pyrimidine
CID 63352862
4-[(3S)-oxolan-3-yl]-7-pyrimidin-2-yl-5,6,8,9-tetrahydropyrimido[4,5-d]azepine
CID 97381312
[2-(oxolan-3-yl)-1H-imidazol-5-yl]methanamine
CID 65329506
1-[(4-bromophenyl)methyl]-3-(oxolan-3-yl)pyrazol-4-amine
CID 113483573
1-(2-methylphenyl)-3-(oxolan-3-yl)pyrazol-4-amine
CID 113483567
2-bromo-5-methyl-6-(oxolan-3-yl)imidazo[2,1-b][1,3,4]thiadiazole
CID 130503537
3,5,7-trimethyl-2-(oxolan-3-yl)imidazo[1,2-a]pyrimidine
CID 114266902

Frequently Asked Questions

What is the IUPAC name of [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite?
The IUPAC name of [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite (CID 155571475) is [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite.
What is the SMILES notation for [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite?
The canonical SMILES for [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite is FSn1cnc(C2CCOC2)c1C1CC1.
What is the InChIKey of [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite?
The InChIKey is JQLHLCQMLLJUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2OS/c11-15-13-6-12-9(8-3-4-14-5-8)10(13)7-1-2-7/h6-8H,1-5H2.
What are the key properties of [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite?
[5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite has a molecular weight of 228.29 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-cyclopropyl-4-(oxolan-3-yl)imidazol-1-yl] thiohypofluorite is sourced from PubChem (CID 155571475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).