N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide

C16H24N2O3S — CID 7600931

IUPACN-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide
SMILESCC[C@@H]1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C16H24N2O3S/c1-2-15-10-6-7-12-18(15)22(20,21)13-11-17-16(19)14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19)/t15-/m1/s1
InChIKeyMXLOIKNWURKFRF-OAHLLOKOSA-N
MW324.45 g/mol
LogP2.01
Rot. Bonds6

About N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide

N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide (PubChem CID 7600931) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide
PubChem CID7600931
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide
SMILESCC[C@@H]1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C16H24N2O3S/c1-2-15-10-6-7-12-18(15)22(20,21)13-11-17-16(19)14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19)/t15-/m1/s1
InChIKeyMXLOIKNWURKFRF-OAHLLOKOSA-N
XLogP2.01
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide
CID 18582812
N-[2-[(3S)-3-methylpiperidin-1-yl]sulfonylethyl]benzamide
CID 7423212
N-[3-(dimethylamino)propyl]-4-(2-ethylpiperidin-1-yl)sulfonylbenzamide
CID 109060249
4-(2-ethylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047836
4-(2-ethylpiperidin-1-yl)sulfonyl-N-(2-methylpropyl)benzamide
CID 109058846
4-(2-ethylpiperidin-1-yl)sulfonyl-N-(2-methylphenyl)benzamide
CID 109061511
N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide
CID 70840667
N-(2-thiomorpholin-4-ylsulfonylethyl)benzamide
CID 56782887
N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 60668475
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358
4-bromo-N-[3-(2-ethylpiperidin-1-yl)-3-oxopropyl]benzamide
CID 51147871
1-(bromomethylsulfonyl)-2-ethylpiperidine
CID 83093366

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide?
The IUPAC name of N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide (CID 7600931) is N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide.
What is the SMILES notation for N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide?
The canonical SMILES for N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide is CC[C@@H]1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1.
What is the InChIKey of N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide?
The InChIKey is MXLOIKNWURKFRF-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-2-15-10-6-7-12-18(15)22(20,21)13-11-17-16(19)14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19)/t15-/m1/s1.
What are the key properties of N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide?
N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide has a molecular weight of 324.45 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide is sourced from PubChem (CID 7600931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).