N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide

C14H22N4O3S — CID 146085172

IUPACN-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide
SMILESCC(c1ccccn1)N(C)C(=O)C1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C14H22N4O3S/c1-11(13-5-3-4-8-16-13)17(2)14(19)12-6-9-18(10-7-12)22(15,20)21/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H2,15,20,21)
InChIKeySQOMQPHVYZVNCG-UHFFFAOYSA-N
MW326.42 g/mol
LogP0.52
Rot. Bonds4

About N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide

N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide (PubChem CID 146085172) has the molecular formula C14H22N4O3S and a molecular weight of 326.42 g/mol. Its IUPAC name is N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide
PubChem CID146085172
Molecular FormulaC14H22N4O3S
Molecular Weight326.42 g/mol
Exact Mass326.14
IUPAC NameN-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide
SMILESCC(c1ccccn1)N(C)C(=O)C1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C14H22N4O3S/c1-11(13-5-3-4-8-16-13)17(2)14(19)12-6-9-18(10-7-12)22(15,20)21/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H2,15,20,21)
InChIKeySQOMQPHVYZVNCG-UHFFFAOYSA-N
XLogP0.52
TPSA96.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-1-(cyclopropylmethyl)-N-methyl-5-oxo-N-[(1R)-1-pyridin-2-ylethyl]pyrrolidine-3-carboxamide
CID 95231445
N-methyl-N-propan-2-yl-1-(pyridine-2-carbonyl)piperidine-4-carboxamide
CID 86983172
N-propyl-N-(2-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide
CID 49030894
(2R)-2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]propanamide
CID 124590926
N,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 163258537
2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 96555130
1-(2,5-dichlorophenyl)sulfonyl-N-methyl-N-(1-phenylethyl)piperidine-4-carboxamide
CID 43022044
N-methyl-N-(2-phenoxyethyl)-1-sulfamoylpiperidine-4-carboxamide
CID 39912164
3-[[(2R)-1-ethylpiperidin-2-yl]methyl]-1-methyl-1-[(1S)-1-pyridin-2-ylethyl]urea
CID 96516588
4-pyridin-2-ylpiperidine-1-sulfonamide
CID 91607486
N-[(3-chlorophenyl)-pyridin-2-ylmethyl]-1-(2,5-dibromophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 166346234
N-[cyano(pyridin-2-yl)methyl]-N-methylcyclohexanecarboxamide
CID 82120784

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide?
The IUPAC name of N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide (CID 146085172) is N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide.
What is the SMILES notation for N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide?
The canonical SMILES for N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide is CC(c1ccccn1)N(C)C(=O)C1CCN(S(N)(=O)=O)CC1.
What is the InChIKey of N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide?
The InChIKey is SQOMQPHVYZVNCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3S/c1-11(13-5-3-4-8-16-13)17(2)14(19)12-6-9-18(10-7-12)22(15,20)21/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H2,15,20,21).
What are the key properties of N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide?
N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide has a molecular weight of 326.42 g/mol, XLogP of 0.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-pyridin-2-ylethyl)-1-sulfamoylpiperidine-4-carboxamide is sourced from PubChem (CID 146085172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).