2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole

C14H14N2O2S — CID 16761146

IUPAC2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole
SMILESCC1=NCCN1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H14N2O2S/c1-11-15-8-9-16(11)19(17,18)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10H,8-9H2,1H3
InChIKeyFQWDUDPWFSHBTM-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.26
Rot. Bonds2

About 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole

2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole (PubChem CID 16761146) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole
PubChem CID16761146
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC Name2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole
SMILESCC1=NCCN1S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H14N2O2S/c1-11-15-8-9-16(11)19(17,18)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10H,8-9H2,1H3
InChIKeyFQWDUDPWFSHBTM-UHFFFAOYSA-N
XLogP2.26
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methylphenyl)methylsulfanyl]-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole
CID 2148732
1-naphthalen-2-ylsulfonylpyrrolidine
CID 819722
1-methyl-4-naphthalen-2-ylsulfonylpiperazine
CID 872090
1-methyl-4-naphthalen-2-ylsulfonyl-1,4-diazepan-1-ium
CID 2429370
2-methyl-1-naphthalen-2-ylsulfonylpiperidine
CID 3745150
4-naphthalen-2-ylsulfonyl-6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidine
CID 98691630
4-cyclopropylidene-1-naphthalen-2-ylsulfonylpiperidine
CID 121187246
1-naphthalen-2-ylsulfonyl-2H-indol-3-one
CID 172633436
1-naphthalen-2-ylsulfonyl-4-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperazine
CID 55428799
1-naphthalen-2-ylsulfonyl-4-phenylpiperidine
CID 4729267
1-(4-methylphenyl)sulfonyl-2-phenyl-4,5-dihydroimidazole
CID 34885089
1-(2-methylprop-2-enyl)-4-naphthalen-2-ylsulfonylpiperazine
CID 8692259

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole?
The IUPAC name of 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole (CID 16761146) is 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole.
What is the SMILES notation for 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole?
The canonical SMILES for 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole is CC1=NCCN1S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole?
The InChIKey is FQWDUDPWFSHBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-11-15-8-9-16(11)19(17,18)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10H,8-9H2,1H3.
What are the key properties of 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole?
2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole has a molecular weight of 274.35 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole is sourced from PubChem (CID 16761146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).