N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide

C7H11N3O2S — CID 165476485

IUPACN-[(6-amino-2-pyridinyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCc1cccc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-13(11,12)9-5-6-3-2-4-7(8)10-6/h2-4,9H,5H2,1H3,(H2,8,10)
InChIKeyNLPIFLDZXVSWIW-UHFFFAOYSA-N
MW201.25 g/mol
LogP-0.29
Rot. Bonds3

About N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide

N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide (PubChem CID 165476485) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(6-amino-2-pyridinyl)methyl]methanesulfonamide
PubChem CID165476485
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC NameN-[(6-amino-2-pyridinyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCc1cccc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-13(11,12)9-5-6-3-2-4-7(8)10-6/h2-4,9H,5H2,1H3,(H2,8,10)
InChIKeyNLPIFLDZXVSWIW-UHFFFAOYSA-N
XLogP-0.29
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide?
The IUPAC name of N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide (CID 165476485) is N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide?
The canonical SMILES for N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide is CS(=O)(=O)NCc1cccc(N)n1.
What is the InChIKey of N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide?
The InChIKey is NLPIFLDZXVSWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-13(11,12)9-5-6-3-2-4-7(8)10-6/h2-4,9H,5H2,1H3,(H2,8,10).
What are the key properties of N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide?
N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide has a molecular weight of 201.25 g/mol, XLogP of -0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2-pyridinyl)methyl]methanesulfonamide is sourced from PubChem (CID 165476485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).