1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine

C13H23N3O2S — CID 106563445

IUPAC1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCCS(C)(=O)=O)n1
InChIInChI=1S/C13H23N3O2S/c1-11-10-16(12-6-4-3-5-7-12)13(15-11)14-8-9-19(2,17)18/h10,12H,3-9H2,1-2H3,(H,14,15)
InChIKeyYXYVOYIBTASALN-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.15
Rot. Bonds5

About 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine

1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine (PubChem CID 106563445) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine
PubChem CID106563445
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC Name1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCCS(C)(=O)=O)n1
InChIInChI=1S/C13H23N3O2S/c1-11-10-16(12-6-4-3-5-7-12)13(15-11)14-8-9-19(2,17)18/h10,12H,3-9H2,1-2H3,(H,14,15)
InChIKeyYXYVOYIBTASALN-UHFFFAOYSA-N
XLogP2.15
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157
N-(2-cyclohexylethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106563352
1-cyclohexyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557289
1-cyclohexyl-N-ethyl-4-methylimidazol-2-amine
CID 106554643
1-cyclohexyl-N-hexyl-4-methylimidazol-2-amine
CID 106573799
N-(2-butoxyethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106568338
1-cyclohexyl-4-methyl-N-[2-(3-methylbutoxy)ethyl]imidazol-2-amine
CID 106568244
1-cyclopentyl-N-(2-methylsulfonylethyl)imidazol-2-amine
CID 106563475
1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106557175
1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine
CID 106555211
1-cyclopentyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106554998
N-(1-cyclopentyl-4-methylimidazol-2-yl)-N'-methyl-N'-propan-2-ylbutane-1,4-diamine
CID 106565750

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine (CID 106563445) is 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine is Cc1cn(C2CCCCC2)c(NCCS(C)(=O)=O)n1.
What is the InChIKey of 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine?
The InChIKey is YXYVOYIBTASALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-11-10-16(12-6-4-3-5-7-12)13(15-11)14-8-9-19(2,17)18/h10,12H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine?
1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine has a molecular weight of 285.41 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methyl-N-(2-methylsulfonylethyl)imidazol-2-amine is sourced from PubChem (CID 106563445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).