(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine

C17H26N2O2S — CID 39699146

IUPAC(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine
SMILESC[C@@H]1CCCCN1S(=O)(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C17H26N2O2S/c1-15-7-5-6-12-19(15)22(20,21)18-13-10-17(11-14-18)16-8-3-2-4-9-16/h2-4,8-9,15,17H,5-7,10-14H2,1H3/t15-/m1/s1
InChIKeyYWYPACDBQBYNEU-OAHLLOKOSA-N
MW322.47 g/mol
LogP2.99
Rot. Bonds3

About (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine

(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine (PubChem CID 39699146) has the molecular formula C17H26N2O2S and a molecular weight of 322.47 g/mol. Its IUPAC name is (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine.

Molecular Properties

Compound Name(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine
PubChem CID39699146
Molecular FormulaC17H26N2O2S
Molecular Weight322.47 g/mol
Exact Mass322.17
IUPAC Name(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine
SMILESC[C@@H]1CCCCN1S(=O)(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C17H26N2O2S/c1-15-7-5-6-12-19(15)22(20,21)18-13-10-17(11-14-18)16-8-3-2-4-9-16/h2-4,8-9,15,17H,5-7,10-14H2,1H3/t15-/m1/s1
InChIKeyYWYPACDBQBYNEU-OAHLLOKOSA-N
XLogP2.99
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.47
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine 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-methyl-1-piperidin-1-ylsulfonylpiperidine
CID 60723774
1-(4-phenylpiperidin-1-yl)sulfonylpiperazine
CID 61251949
1-(2-methylpiperidin-1-yl)sulfonylpiperidine-4-carbonitrile
CID 62075705
1-[(2R)-2-phenylpyrrolidin-1-yl]sulfonylazepane
CID 31110887
1-tert-butylsulfonyl-4-phenylpiperidine
CID 20680839
1-[(3-methyl-2H-imidazol-1-yl)sulfonyl]-4-phenylpiperidine
CID 155756449
1-methyl-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-1,4-diazepane
CID 94021502
4-[4-(2-methylpiperidin-1-yl)sulfonylpiperazin-1-yl]sulfonylmorpholine
CID 55598118
(2R)-1-[4-(1H-pyrrol-3-yl)piperidin-1-yl]sulfonylpiperidine-2-carboxylic acid
CID 18727219
N-[[1-(2-methylpiperidin-1-yl)sulfonylpiperidin-4-yl]methyl]cyclopropanamine
CID 63855296
1-(chloromethylsulfonyl)-4-phenylpiperidine
CID 63664113
2-[1-(2-methylpiperidin-1-yl)sulfonylpiperidin-4-yl]acetamide
CID 47319363

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine?
The IUPAC name of (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine (CID 39699146) is (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine.
What is the SMILES notation for (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine?
The canonical SMILES for (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine is C[C@@H]1CCCCN1S(=O)(=O)N1CCC(c2ccccc2)CC1.
What is the InChIKey of (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine?
The InChIKey is YWYPACDBQBYNEU-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H26N2O2S/c1-15-7-5-6-12-19(15)22(20,21)18-13-10-17(11-14-18)16-8-3-2-4-9-16/h2-4,8-9,15,17H,5-7,10-14H2,1H3/t15-/m1/s1.
What are the key properties of (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine?
(2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine has a molecular weight of 322.47 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-(4-phenylpiperidin-1-yl)sulfonylpiperidine is sourced from PubChem (CID 39699146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).