N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide

C12H19N3O2S — CID 113015667

IUPACN-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide
SMILESCC1CCCN(c2ccc(NS(C)(=O)=O)cn2)C1
InChIInChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)12-6-5-11(8-13-12)14-18(2,16)17/h5-6,8,10,14H,3-4,7,9H2,1-2H3
InChIKeyVKDBJWQBFDKJMK-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.69
Rot. Bonds3

About N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide

N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide (PubChem CID 113015667) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide.

Molecular Properties

Compound NameN-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide
PubChem CID113015667
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide
SMILESCC1CCCN(c2ccc(NS(C)(=O)=O)cn2)C1
InChIInChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)12-6-5-11(8-13-12)14-18(2,16)17/h5-6,8,10,14H,3-4,7,9H2,1-2H3
InChIKeyVKDBJWQBFDKJMK-UHFFFAOYSA-N
XLogP1.69
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]-4-propan-2-yloxybenzenesulfonamide
CID 113015711
2,5-dimethoxy-N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]benzenesulfonamide
CID 113015691
N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]cyclobutanecarboxamide
CID 113015663
2-amino-N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]acetamide
CID 82034957
ethyl N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]carbamate
CID 113015658
N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]oxane-4-carboxamide
CID 113015664
3,5-dimethoxy-N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]benzamide
CID 113015617
N-[[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 55055089
1-[6-[(3S)-3-methylpiperidin-1-yl]-3-pyridinyl]-3-[(1R)-1-phenylethyl]thiourea
CID 125045221
N-(6-fluoro-3-pyridinyl)-3-methylpiperidine-1-sulfonamide
CID 103777926
6-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109161701
1-[5-[(4-propan-2-ylphenyl)sulfonylamino]-2-pyridinyl]piperidine-3-carboxamide
CID 86967490

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide?
The IUPAC name of N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide (CID 113015667) is N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide.
What is the SMILES notation for N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide?
The canonical SMILES for N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide is CC1CCCN(c2ccc(NS(C)(=O)=O)cn2)C1.
What is the InChIKey of N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide?
The InChIKey is VKDBJWQBFDKJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)12-6-5-11(8-13-12)14-18(2,16)17/h5-6,8,10,14H,3-4,7,9H2,1-2H3.
What are the key properties of N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide?
N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methanesulfonamide is sourced from PubChem (CID 113015667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).