1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine

C11H14FNOS — CID 64657955

IUPAC1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine
SMILESNC(CS(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H14FNOS/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8,10H,5-7,13H2
InChIKeyMXABVOWASZCPAJ-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.67
Rot. Bonds4

About 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine

1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine (PubChem CID 64657955) has the molecular formula C11H14FNOS and a molecular weight of 227.30 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine
PubChem CID64657955
Molecular FormulaC11H14FNOS
Molecular Weight227.30 g/mol
Exact Mass227.08
IUPAC Name1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine
SMILESNC(CS(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H14FNOS/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8,10H,5-7,13H2
InChIKeyMXABVOWASZCPAJ-UHFFFAOYSA-N
XLogP1.67
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(2,5-difluorophenyl)sulfinylethanamine
CID 104754679
2-(2-bromophenyl)sulfinyl-1-cyclohexylethanamine
CID 113449406
1-(2-fluorophenyl)sulfinylbutan-2-amine
CID 64658337
1,1,1-trifluoro-3-(2-fluorophenyl)sulfinylpropan-2-ol
CID 64717098
1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone
CID 64635571
1-(2-fluorophenyl)sulfinyl-3-propan-2-yloxypropan-2-ol
CID 64717959
2-[2-(2-fluorophenyl)sulfinylethyl]cyclopentan-1-amine
CID 79581435
2-[(2-fluorophenyl)sulfinylmethyl]oxirane
CID 115474734
1-cyclopentyl-2-(2-fluorophenyl)sulfinylethanone
CID 104756239
1-cyclopropyl-2-(3,4-dimethylphenyl)sulfinylethanamine
CID 64659864
3,3,3-trifluoro-2-[(2-fluorophenyl)sulfinylmethyl]propanenitrile
CID 103372465
1-fluoro-2-propylsulfinylbenzene
CID 64717305

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine?
The IUPAC name of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine (CID 64657955) is 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine?
The canonical SMILES for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine is NC(CS(=O)c1ccccc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine?
The InChIKey is MXABVOWASZCPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNOS/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8,10H,5-7,13H2.
What are the key properties of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine?
1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine has a molecular weight of 227.30 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine is sourced from PubChem (CID 64657955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).