1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine

C17H19FN2O2S — CID 123166621

IUPAC1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine
SMILESNC1(c2ccccc2)CCN(S(=O)(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C17H19FN2O2S/c18-15-7-4-8-16(13-15)23(21,22)20-11-9-17(19,10-12-20)14-5-2-1-3-6-14/h1-8,13H,9-12,19H2
InChIKeyZKCBLVBRSLVEJB-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.46
Rot. Bonds3

About 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine

1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine (PubChem CID 123166621) has the molecular formula C17H19FN2O2S and a molecular weight of 334.42 g/mol. Its IUPAC name is 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine
PubChem CID123166621
Molecular FormulaC17H19FN2O2S
Molecular Weight334.42 g/mol
Exact Mass334.12
IUPAC Name1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine
SMILESNC1(c2ccccc2)CCN(S(=O)(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C17H19FN2O2S/c18-15-7-4-8-16(13-15)23(21,22)20-11-9-17(19,10-12-20)14-5-2-1-3-6-14/h1-8,13H,9-12,19H2
InChIKeyZKCBLVBRSLVEJB-UHFFFAOYSA-N
XLogP2.46
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-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

8-(3-fluorophenyl)sulfonyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CID 23853075
8-(3-fluorophenyl)sulfonyl-3-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 16896776
1-(3,4-dichlorophenyl)sulfonyl-4-(3-fluorophenyl)sulfonylpiperazine
CID 55352199
1-(3-fluorophenyl)sulfonyl-2,5-dihydropyrrole
CID 3830927
1-(3-fluorophenyl)sulfonylpiperidine-4-carboxylic acid
CID 16775048
(3R)-1'-(3-fluorophenyl)sulfonyl-1-methylspiro[indole-3,3'-pyrrolidine]-2-one
CID 95104009
1-(3-fluorophenyl)sulfonyl-4-phenyl-3,6-dihydro-2H-pyridine
CID 3715757
3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 42909139
1-(benzenesulfonyl)-4,4-dimethylpiperidine
CID 58376409
1-(3-fluorophenyl)sulfonyl-4-methylsulfonylpiperidine
CID 90585208
3-(benzenesulfonyl)-7-(3-fluorophenyl)sulfonyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
CID 53164994
1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-phenylbutane-1,4-dione
CID 4820420

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine?
The IUPAC name of 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine (CID 123166621) is 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine.
What is the SMILES notation for 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine?
The canonical SMILES for 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine is NC1(c2ccccc2)CCN(S(=O)(=O)c2cccc(F)c2)CC1.
What is the InChIKey of 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine?
The InChIKey is ZKCBLVBRSLVEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2S/c18-15-7-4-8-16(13-15)23(21,22)20-11-9-17(19,10-12-20)14-5-2-1-3-6-14/h1-8,13H,9-12,19H2.
What are the key properties of 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine?
1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine has a molecular weight of 334.42 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)sulfonyl-4-phenylpiperidin-4-amine is sourced from PubChem (CID 123166621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).