1-(methoxymethyl)-2-phenylsulfanylimidazole

C11H12N2OS — CID 11020414

IUPAC1-(methoxymethyl)-2-phenylsulfanylimidazole
SMILESCOCn1ccnc1Sc1ccccc1
InChIInChI=1S/C11H12N2OS/c1-14-9-13-8-7-12-11(13)15-10-5-3-2-4-6-10/h2-8H,9H2,1H3
InChIKeyGBNYQUIYMCRWFY-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.64
Rot. Bonds4

About 1-(methoxymethyl)-2-phenylsulfanylimidazole

1-(methoxymethyl)-2-phenylsulfanylimidazole (PubChem CID 11020414) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 1-(methoxymethyl)-2-phenylsulfanylimidazole.

Molecular Properties

Compound Name1-(methoxymethyl)-2-phenylsulfanylimidazole
PubChem CID11020414
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name1-(methoxymethyl)-2-phenylsulfanylimidazole
SMILESCOCn1ccnc1Sc1ccccc1
InChIInChI=1S/C11H12N2OS/c1-14-9-13-8-7-12-11(13)15-10-5-3-2-4-6-10/h2-8H,9H2,1H3
InChIKeyGBNYQUIYMCRWFY-UHFFFAOYSA-N
XLogP2.64
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(methoxymethyl)-2-phenylsulfanylimidazole 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

1-(4-Phenylsulfanylbutyl)imidazole
CID 58580494
1-Methylimidazole, 2-benzylthio-
CID 563318
5-phenylsulfanyl-1H-imidazole
CID 4365996
2-[2-(Benzenesulfonyl)ethylsulfanyl]-1-methylimidazole
CID 2821197
1H-Imidazole-1-sulfonamide, N,N-dimethyl-2-(phenylthio)-
CID 3730978
2-(Phenylthio)imidazole
CID 21994921
1-Methyl-2-phenylsulfanyl-1H-imidazole
CID 10241768
2-(Phenylthio)-1-[[2-(trimethylsilyl)ethoxy]methyl]-1H-imidazole
CID 11232041
1-Methyl-2-(4-methylphenyl)sulfanylimidazole
CID 11333187
1-Ethoxymethyl-5-methylsulfanyl-2-phenylsulfanyl-1h-imidazole
CID 12840603
2-(Benzenesulfonylmethyl)-1-methylimidazole
CID 72151013
1-Methyl-2-[4-(trifluoromethyl)phenyl]sulfanylimidazole
CID 15077504

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-2-phenylsulfanylimidazole?
The IUPAC name of 1-(methoxymethyl)-2-phenylsulfanylimidazole (CID 11020414) is 1-(methoxymethyl)-2-phenylsulfanylimidazole.
What is the SMILES notation for 1-(methoxymethyl)-2-phenylsulfanylimidazole?
The canonical SMILES for 1-(methoxymethyl)-2-phenylsulfanylimidazole is COCn1ccnc1Sc1ccccc1.
What is the InChIKey of 1-(methoxymethyl)-2-phenylsulfanylimidazole?
The InChIKey is GBNYQUIYMCRWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c1-14-9-13-8-7-12-11(13)15-10-5-3-2-4-6-10/h2-8H,9H2,1H3.
What are the key properties of 1-(methoxymethyl)-2-phenylsulfanylimidazole?
1-(methoxymethyl)-2-phenylsulfanylimidazole has a molecular weight of 220.30 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-2-phenylsulfanylimidazole is sourced from PubChem (CID 11020414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).