N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide

C12H19N3O3S — CID 62989771

IUPACN-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide
SMILESCOc1ccc(CNS(=O)(=O)C2CCCNC2)cn1
InChIInChI=1S/C12H19N3O3S/c1-18-12-5-4-10(7-14-12)8-15-19(16,17)11-3-2-6-13-9-11/h4-5,7,11,13,15H,2-3,6,8-9H2,1H3
InChIKeyFAAHGRFBLGTIEX-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.26
Rot. Bonds5

About N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide

N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide (PubChem CID 62989771) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide
PubChem CID62989771
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC NameN-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide
SMILESCOc1ccc(CNS(=O)(=O)C2CCCNC2)cn1
InChIInChI=1S/C12H19N3O3S/c1-18-12-5-4-10(7-14-12)8-15-19(16,17)11-3-2-6-13-9-11/h4-5,7,11,13,15H,2-3,6,8-9H2,1H3
InChIKeyFAAHGRFBLGTIEX-UHFFFAOYSA-N
XLogP0.26
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-sulfonamide
CID 114956767
N-[(3-chloro-4-fluorophenyl)methyl]piperidine-3-sulfonamide
CID 62532599
N-(2-methoxy-4-pyridinyl)piperidine-3-sulfonamide
CID 112739564
2-methoxy-5-[(3R)-piperidin-3-yl]pyridine
CID 93478601
N-(furan-2-ylmethyl)piperidine-3-sulfonamide
CID 24690010
N-[(6-methyl-2-pyridinyl)methyl]piperidine-3-sulfonamide
CID 62307379
N-[(5-ethylthiophen-2-yl)methyl]piperidine-3-sulfonamide
CID 106013660
N-benzylpyrrolidine-3-sulfonamide
CID 65420907
2-chloro-N-[(6-methoxy-3-pyridinyl)methyl]ethanesulfonamide
CID 107651707
N-[(6-methoxy-3-pyridinyl)methyl]-4-propylbenzenesulfonamide
CID 51320441
N-[(6-methoxy-3-pyridinyl)methyl]-4-(methylamino)benzenesulfonamide
CID 62989325
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylsulfonylcyclopentan-1-amine
CID 65046504

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide?
The IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide (CID 62989771) is N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide.
What is the SMILES notation for N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide?
The canonical SMILES for N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide is COc1ccc(CNS(=O)(=O)C2CCCNC2)cn1.
What is the InChIKey of N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide?
The InChIKey is FAAHGRFBLGTIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-18-12-5-4-10(7-14-12)8-15-19(16,17)11-3-2-6-13-9-11/h4-5,7,11,13,15H,2-3,6,8-9H2,1H3.
What are the key properties of N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide?
N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide has a molecular weight of 285.37 g/mol, XLogP of 0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-3-pyridinyl)methyl]piperidine-3-sulfonamide is sourced from PubChem (CID 62989771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).