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

C14H20FNOS — CID 64658139

IUPAC4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine
SMILESCCC1CCC(N)C(S(=O)c2ccccc2F)C1
InChIInChI=1S/C14H20FNOS/c1-2-10-7-8-12(16)14(9-10)18(17)13-6-4-3-5-11(13)15/h3-6,10,12,14H,2,7-9,16H2,1H3
InChIKeyLUGNZESGEULPNW-UHFFFAOYSA-N
MW269.38 g/mol
LogP2.84
Rot. Bonds3

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

4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine (PubChem CID 64658139) has the molecular formula C14H20FNOS and a molecular weight of 269.38 g/mol. Its IUPAC name is 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine
PubChem CID64658139
Molecular FormulaC14H20FNOS
Molecular Weight269.38 g/mol
Exact Mass269.12
IUPAC Name4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine
SMILESCCC1CCC(N)C(S(=O)c2ccccc2F)C1
InChIInChI=1S/C14H20FNOS/c1-2-10-7-8-12(16)14(9-10)18(17)13-6-4-3-5-11(13)15/h3-6,10,12,14H,2,7-9,16H2,1H3
InChIKeyLUGNZESGEULPNW-UHFFFAOYSA-N
XLogP2.84
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-2-(2-fluorophenyl)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

2-(2,4-difluorophenyl)sulfinyl-4-ethylcyclohexan-1-amine
CID 64652416
4-ethyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
CID 64654145
4-ethyl-2-(2-fluorophenyl)sulfinyl-N-propylcyclohexan-1-amine
CID 64657752
2-(2-fluorophenyl)sulfinyl-4-propylcyclohexane-1-carbonitrile
CID 64689837
4-ethyl-2-[(2-methylphenyl)methylsulfinyl]cyclohexan-1-amine
CID 64658995
4-ethyl-2-methylsulfinylcyclohexan-1-amine
CID 64656221
4-ethyl-N-methyl-2-(2-methylphenyl)sulfinylcyclohexan-1-amine
CID 64656382
2-(2-chlorophenyl)sulfinyl-4-ethylcyclohexane-1-carbonitrile
CID 64690449
4-(3-ethylcyclohexyl)sulfinyl-3-fluoroaniline
CID 81191814
2-(2-fluorophenyl)sulfinylcyclohexan-1-ol
CID 64717103
2-(2-bromophenyl)sulfinyl-4-ethyl-N-propylcyclohexan-1-amine
CID 64651402
2-(3,4-dimethylphenyl)sulfinyl-4-propylcyclohexan-1-amine
CID 64659467

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine (CID 64658139) is 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine is CCC1CCC(N)C(S(=O)c2ccccc2F)C1.
What is the InChIKey of 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine?
The InChIKey is LUGNZESGEULPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNOS/c1-2-10-7-8-12(16)14(9-10)18(17)13-6-4-3-5-11(13)15/h3-6,10,12,14H,2,7-9,16H2,1H3.
What are the key properties of 4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine?
4-ethyl-2-(2-fluorophenyl)sulfinylcyclohexan-1-amine has a molecular weight of 269.38 g/mol, XLogP of 2.84, 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-fluorophenyl)sulfinylcyclohexan-1-amine is sourced from PubChem (CID 64658139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).