N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide

C15H22N2O3S — CID 18582812

IUPACN-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide
SMILESCC1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C15H22N2O3S/c1-13-7-5-6-11-17(13)21(19,20)12-10-16-15(18)14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H,16,18)
InChIKeyHORIXEKDLJRKAX-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.62
Rot. Bonds5

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

N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide (PubChem CID 18582812) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide.

Molecular Properties

Compound NameN-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide
PubChem CID18582812
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide
SMILESCC1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C15H22N2O3S/c1-13-7-5-6-11-17(13)21(19,20)12-10-16-15(18)14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H,16,18)
InChIKeyHORIXEKDLJRKAX-UHFFFAOYSA-N
XLogP1.62
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(2R)-2-ethylpiperidin-1-yl]sulfonylethyl]benzamide
CID 7600931
3-(4,5-dimethyl-3-oxo-1H-pyrazol-2-yl)-N-[2-[(2S)-2-methylpiperidin-1-yl]sulfonylethyl]benzamide
CID 51596446
N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 60668475
N-[2-[(3S)-3-methylpiperidin-1-yl]sulfonylethyl]benzamide
CID 7423212
2-methyl-N-phenacylpiperidine-1-sulfonamide
CID 64994247
N-(3-aminopropyl)-4-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 119408692
N-(2-methylpiperidin-1-yl)benzamide
CID 72760712
N-[2-[3-(2-methylpiperidin-1-yl)propylamino]-2-oxoethyl]benzamide
CID 85018800
N-(2-thiomorpholin-4-ylsulfonylethyl)benzamide
CID 56782887
N-[3-(2-methoxyethoxy)propyl]-4-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 55408143
4-(2-methylpiperidin-1-yl)sulfonylbutanoic acid
CID 43209512
N-[2-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]ethyl]pyridine-4-carboxamide
CID 110291796

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide?
The IUPAC name of N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide (CID 18582812) is N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide.
What is the SMILES notation for N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide?
The canonical SMILES for N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide is CC1CCCCN1S(=O)(=O)CCNC(=O)c1ccccc1.
What is the InChIKey of N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide?
The InChIKey is HORIXEKDLJRKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-13-7-5-6-11-17(13)21(19,20)12-10-16-15(18)14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H,16,18).
What are the key properties of N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide?
N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide has a molecular weight of 310.42 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide is sourced from PubChem (CID 18582812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).