fluoroform;1H-imidazole;sulfane

C4H7F3N2S — CID 174850225

IUPACfluoroform;1H-imidazole;sulfane
SMILESFC(F)F.S.c1c[nH]cn1
InChIInChI=1S/C3H4N2.CHF3.H2S/c1-2-5-3-4-1;2-1(3)4;/h1-3H,(H,4,5);1H;1H2
InChIKeyNMOGRBOCKYCKMC-UHFFFAOYSA-N
MW172.18 g/mol
LogP1.70
Rot. Bonds

About fluoroform;1H-imidazole;sulfane

fluoroform;1H-imidazole;sulfane (PubChem CID 174850225) has the molecular formula C4H7F3N2S and a molecular weight of 172.18 g/mol. Its IUPAC name is fluoroform;1H-imidazole;sulfane.

Molecular Properties

Compound Namefluoroform;1H-imidazole;sulfane
PubChem CID174850225
Molecular FormulaC4H7F3N2S
Molecular Weight172.18 g/mol
Exact Mass172.03
IUPAC Namefluoroform;1H-imidazole;sulfane
SMILESFC(F)F.S.c1c[nH]cn1
InChIInChI=1S/C3H4N2.CHF3.H2S/c1-2-5-3-4-1;2-1(3)4;/h1-3H,(H,4,5);1H;1H2
InChIKeyNMOGRBOCKYCKMC-UHFFFAOYSA-N
XLogP1.70
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze fluoroform;1H-imidazole;sulfane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Imidazole
CID 795
2-Methylimidazole
CID 12749
2-Ethylimidazole
CID 66130
2-Aminoimidazole
CID 82140
Imidazolium chloride
CID 10197644
2-Bromo-1H-imidazole
CID 2773261
4-iodo-1H-imidazole
CID 606522
2-Mercapto-1-methylimidazole
CID 21989623
2-chloro-1H-imidazole
CID 2773328
2-(methylsulfanyl)-1H-imidazole
CID 134652
1H-imidazole-2-carbonitrile
CID 564456
4-Aminoimidazole
CID 484

Frequently Asked Questions

What is the IUPAC name of fluoroform;1H-imidazole;sulfane?
The IUPAC name of fluoroform;1H-imidazole;sulfane (CID 174850225) is fluoroform;1H-imidazole;sulfane.
What is the SMILES notation for fluoroform;1H-imidazole;sulfane?
The canonical SMILES for fluoroform;1H-imidazole;sulfane is FC(F)F.S.c1c[nH]cn1.
What is the InChIKey of fluoroform;1H-imidazole;sulfane?
The InChIKey is NMOGRBOCKYCKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.CHF3.H2S/c1-2-5-3-4-1;2-1(3)4;/h1-3H,(H,4,5);1H;1H2.
What are the key properties of fluoroform;1H-imidazole;sulfane?
fluoroform;1H-imidazole;sulfane has a molecular weight of 172.18 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroform;1H-imidazole;sulfane is sourced from PubChem (CID 174850225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).