4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine

C15H23NOS — CID 64654145

IUPAC4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
SMILESCCC1CCC(N)C(S(=O)c2ccccc2C)C1
InChIInChI=1S/C15H23NOS/c1-3-12-8-9-13(16)15(10-12)18(17)14-7-5-4-6-11(14)2/h4-7,12-13,15H,3,8-10,16H2,1-2H3
InChIKeyOQWQNTHUYRNKEO-UHFFFAOYSA-N
MW265.42 g/mol
LogP3.01
Rot. Bonds3

About 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine

4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine (PubChem CID 64654145) has the molecular formula C15H23NOS and a molecular weight of 265.42 g/mol. Its IUPAC name is 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
PubChem CID64654145
Molecular FormulaC15H23NOS
Molecular Weight265.42 g/mol
Exact Mass265.15
IUPAC Name4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
SMILESCCC1CCC(N)C(S(=O)c2ccccc2C)C1
InChIInChI=1S/C15H23NOS/c1-3-12-8-9-13(16)15(10-12)18(17)14-7-5-4-6-11(14)2/h4-7,12-13,15H,3,8-10,16H2,1-2H3
InChIKeyOQWQNTHUYRNKEO-UHFFFAOYSA-N
XLogP3.01
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-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

4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine
CID 64658139
4-ethyl-N-methyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
CID 64656382
4-ethyl-2-[(2-methylphenyl)methylsulfinyl]cyclohexan-1-amine
CID 64658995
2-(2,4-difluorophenyl)sulfinyl-4-ethylcyclohexan-1-amine
CID 64652416
4-ethyl-2-methylsulfinylcyclohexan-1-amine
CID 64656221
2-(3,4-dimethylphenyl)sulfinyl-4-propylcyclohexan-1-amine
CID 64659467
[2-(2-methylphenyl)sulfinylcycloheptyl]methanamine
CID 81328475
2-(2-chlorophenyl)sulfinyl-4-ethylcyclohexane-1-carbonitrile
CID 64690449
2-(2,4-dimethylphenyl)sulfinyl-N,4-diethylcyclohexan-1-amine
CID 64659873
2-(2,4-dimethylphenyl)sulfinyl-4-methylcyclohexan-1-amine
CID 64658119
N-ethyl-2-(2-methylphenyl)sulfinylcycloheptan-1-amine
CID 64656783
2-(2-methylphenyl)sulfinyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64657189

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine (CID 64654145) is 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine is CCC1CCC(N)C(S(=O)c2ccccc2C)C1.
What is the InChIKey of 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine?
The InChIKey is OQWQNTHUYRNKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NOS/c1-3-12-8-9-13(16)15(10-12)18(17)14-7-5-4-6-11(14)2/h4-7,12-13,15H,3,8-10,16H2,1-2H3.
What are the key properties of 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine?
4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine has a molecular weight of 265.42 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine is sourced from PubChem (CID 64654145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).