N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine

C14H25N3OS — CID 106582432

IUPACN-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine
SMILESCC(CCS(C)=O)n1ccnc1NC1CCCCC1
InChIInChI=1S/C14H25N3OS/c1-12(8-11-19(2)18)17-10-9-15-14(17)16-13-6-4-3-5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyHGBKRRVTOVSIEK-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.96
Rot. Bonds6

About N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine

N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine (PubChem CID 106582432) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine
PubChem CID106582432
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC NameN-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine
SMILESCC(CCS(C)=O)n1ccnc1NC1CCCCC1
InChIInChI=1S/C14H25N3OS/c1-12(8-11-19(2)18)17-10-9-15-14(17)16-13-6-4-3-5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyHGBKRRVTOVSIEK-UHFFFAOYSA-N
XLogP2.96
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine 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

N-cyclopentyl-1-pentan-3-ylimidazol-2-amine
CID 106555020
N-cyclopropyl-1-(3-methylsulfinylpropyl)imidazol-2-amine
CID 106580550
N-cyclohexyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
CID 106567961
3-(cycloheptylamino)-1-propan-2-ylpyrazin-2-one
CID 62939319
1-[1-(4-chlorophenyl)ethyl]-N-cyclohexylimidazol-2-amine
CID 106565810
1-[1-(4-bromophenyl)ethyl]-N-cyclohexylimidazol-2-amine
CID 106566865
N-cyclopentyl-1-(2-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106577778
N-(1-propan-2-ylimidazol-2-yl)piperidin-4-amine
CID 115026071
N-cyclohexyl-1-methylimidazol-2-amine
CID 57183550
1-(1-methoxypropan-2-yl)-N-(1-methylpyrrolidin-3-yl)imidazol-2-amine
CID 106566534
N-(1-cyclopentylethyl)-1-propan-2-ylimidazol-2-amine
CID 106573564
N-(1,1-dioxothiolan-3-yl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106557898

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine?
The IUPAC name of N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine (CID 106582432) is N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine.
What is the SMILES notation for N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine?
The canonical SMILES for N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine is CC(CCS(C)=O)n1ccnc1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine?
The InChIKey is HGBKRRVTOVSIEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-12(8-11-19(2)18)17-10-9-15-14(17)16-13-6-4-3-5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16).
What are the key properties of N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine?
N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine has a molecular weight of 283.44 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106582432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).