N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide

C11H18N4O2S — CID 63063634

IUPACN-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)Nc1ccncc1N
InChIInChI=1S/C11H18N4O2S/c1-9-4-2-3-7-15(9)18(16,17)14-11-5-6-13-8-10(11)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,14)
InChIKeyAHOZLWVRRVTODL-UHFFFAOYSA-N
MW270.36 g/mol
LogP1.19
Rot. Bonds3

About N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide

N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide (PubChem CID 63063634) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide
PubChem CID63063634
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC NameN-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)Nc1ccncc1N
InChIInChI=1S/C11H18N4O2S/c1-9-4-2-3-7-15(9)18(16,17)14-11-5-6-13-8-10(11)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,14)
InChIKeyAHOZLWVRRVTODL-UHFFFAOYSA-N
XLogP1.19
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-4-pyridinyl)-4-methylpiperidine-1-sulfonamide
CID 55147573
N-(2-amino-5-methylphenyl)-2-methylpiperidine-1-sulfonamide
CID 112557464
N-(3-amino-4-pyridinyl)piperidine-1-sulfonamide
CID 63063461
N-(4-amino-2-bromophenyl)-2-methylpiperidine-1-sulfonamide
CID 43550872
2-(aminomethyl)-N-(3-fluoro-4-pyridinyl)piperidine-1-sulfonamide
CID 106090138
2-[(2-methylpiperidin-1-yl)sulfonylamino]benzoic acid
CID 43210819
N-(4-bromo-2-fluorophenyl)-2-methylpiperidine-1-sulfonamide
CID 43096857
N-(2-chloro-4-iodophenyl)-2-methylpiperidine-1-sulfonamide
CID 107606867
N-[4-(3-aminoprop-1-ynyl)-2-pyridinyl]-2-methylpiperidine-1-sulfonamide
CID 102821759
2-methyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)piperidine-1-sulfonamide
CID 43093895
N-[2-(3-aminoprop-1-ynyl)phenyl]-2-methylpiperidine-1-sulfonamide
CID 60814619
4-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
CID 63651770

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide?
The IUPAC name of N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide (CID 63063634) is N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)Nc1ccncc1N.
What is the InChIKey of N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide?
The InChIKey is AHOZLWVRRVTODL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-9-4-2-3-7-15(9)18(16,17)14-11-5-6-13-8-10(11)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,14).
What are the key properties of N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide?
N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide has a molecular weight of 270.36 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 63063634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).