(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide

C15H24N4O3S — CID 94677155

IUPAC(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccccn1
InChIInChI=1S/C15H24N4O3S/c1-23(21,22)18-10-8-14-7-3-5-11-19(14)15(20)17-12-13-6-2-4-9-16-13/h2,4,6,9,14,18H,3,5,7-8,10-12H2,1H3,(H,17,20)/t14-/m0/s1
InChIKeyILENUMCJIAMIPS-AWEZNQCLSA-N
MW340.45 g/mol
LogP1.09
Rot. Bonds6

About (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide

(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide (PubChem CID 94677155) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide
PubChem CID94677155
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC Name(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccccn1
InChIInChI=1S/C15H24N4O3S/c1-23(21,22)18-10-8-14-7-3-5-11-19(14)15(20)17-12-13-6-2-4-9-16-13/h2,4,6,9,14,18H,3,5,7-8,10-12H2,1H3,(H,17,20)/t14-/m0/s1
InChIKeyILENUMCJIAMIPS-AWEZNQCLSA-N
XLogP1.09
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide
CID 47066287
N-[[4-(dimethylamino)phenyl]methyl]-2-[2-(methanesulfonamido)ethyl]piperidine-1-carboxamide
CID 87010050
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-(2-pyridin-2-ylethyl)piperidine-1-carboxamide
CID 119065952
(2R)-N-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-2-(2-pyridin-2-ylethyl)piperidine-1-carboxamide
CID 125447226
N-[2-[(2S)-1-(1H-pyrazole-5-carbonyl)piperidin-2-yl]ethyl]methanesulfonamide
CID 92634332
N-[2-[1-(2-chloroacetyl)piperidin-2-yl]ethyl]methanesulfonamide
CID 54875968
N-[2-[1-[2-(2-methoxyphenyl)acetyl]piperidin-2-yl]ethyl]methanesulfonamide
CID 87009533
4-(2-ethylpiperidine-1-carbonyl)-N-(pyridin-2-ylmethyl)benzamide
CID 109047547
N-[2-[1-(pyridine-3-carbonyl)pyrrolidin-2-yl]ethyl]methanesulfonamide
CID 127245086
N-[2-[(2R)-1-[2-(methylamino)pyrimidine-5-carbonyl]piperidin-2-yl]ethyl]methanesulfonamide
CID 92632029
N-[2-[(2S)-1-[2-(benzotriazol-1-yl)acetyl]piperidin-2-yl]ethyl]methanesulfonamide
CID 92634296
N-[2-[1-(2-methylpropanoyl)piperidin-2-yl]ethyl]methanesulfonamide
CID 61215595

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide (CID 94677155) is (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide is CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccccn1.
What is the InChIKey of (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide?
The InChIKey is ILENUMCJIAMIPS-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-23(21,22)18-10-8-14-7-3-5-11-19(14)15(20)17-12-13-6-2-4-9-16-13/h2,4,6,9,14,18H,3,5,7-8,10-12H2,1H3,(H,17,20)/t14-/m0/s1.
What are the key properties of (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide?
(2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[2-(methanesulfonamido)ethyl]-N-(pyridin-2-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 94677155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).