(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide

C14H28N2O2S — CID 35294415

IUPAC(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide
SMILESC[C@H]1CCCCN1S(=O)(=O)NC1CCCCCCC1
InChIInChI=1S/C14H28N2O2S/c1-13-9-7-8-12-16(13)19(17,18)15-14-10-5-3-2-4-6-11-14/h13-15H,2-12H2,1H3/t13-/m0/s1
InChIKeyBGTHKDPCGWFMFW-ZDUSSCGKSA-N
MW288.46 g/mol
LogP2.81
Rot. Bonds3

About (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide

(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide (PubChem CID 35294415) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide
PubChem CID35294415
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC Name(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide
SMILESC[C@H]1CCCCN1S(=O)(=O)NC1CCCCCCC1
InChIInChI=1S/C14H28N2O2S/c1-13-9-7-8-12-16(13)19(17,18)15-14-10-5-3-2-4-6-11-14/h13-15H,2-12H2,1H3/t13-/m0/s1
InChIKeyBGTHKDPCGWFMFW-ZDUSSCGKSA-N
XLogP2.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-methylpiperidine-1-sulfonamide
CID 47164661
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-methylpiperidine-1-sulfonamide
CID 61230456
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpiperidine-1-sulfonamide
CID 104922367
N-cycloheptylpiperidine-1-sulfonamide
CID 110705910
2-[(2-methylpiperidin-1-yl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 64817232
N-(1-benzylpiperidin-3-yl)-2-methylpiperidine-1-sulfonamide
CID 55682031
N-cyclohexyl-4-methylpiperidine-1-sulfonamide
CID 60728637
(2S)-2-methylpiperidine-1-sulfonyl chloride
CID 98117610
(2S)-N-[(2R)-butan-2-yl]-2-methylpiperidine-1-sulfonamide
CID 95277876
1-(cyclopropylsulfamoyl)azepane-2-carboxylic acid
CID 114533609
(2R,3R)-1-(cyclopentylsulfamoyl)-2-methylpiperidine-3-carboxylic acid
CID 122104880
2-methyl-N-(1,2,3,4-tetrahydroquinolin-3-yl)piperidine-1-sulfonamide
CID 43109899

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide?
The IUPAC name of (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide (CID 35294415) is (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide is C[C@H]1CCCCN1S(=O)(=O)NC1CCCCCCC1.
What is the InChIKey of (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide?
The InChIKey is BGTHKDPCGWFMFW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H28N2O2S/c1-13-9-7-8-12-16(13)19(17,18)15-14-10-5-3-2-4-6-11-14/h13-15H,2-12H2,1H3/t13-/m0/s1.
What are the key properties of (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide?
(2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide has a molecular weight of 288.46 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclooctyl-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 35294415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).