N-(6-ethoxy-2-pyridinyl)methanesulfonamide

C8H12N2O3S — CID 86799055

IUPACN-(6-ethoxy-2-pyridinyl)methanesulfonamide
SMILESCCOc1cccc(NS(C)(=O)=O)n1
InChIInChI=1S/C8H12N2O3S/c1-3-13-8-6-4-5-7(9-8)10-14(2,11)12/h4-6H,3H2,1-2H3,(H,9,10)
InChIKeyYDWJPXYMDPYGSE-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.85
Rot. Bonds4

About N-(6-ethoxy-2-pyridinyl)methanesulfonamide

N-(6-ethoxy-2-pyridinyl)methanesulfonamide (PubChem CID 86799055) has the molecular formula C8H12N2O3S and a molecular weight of 216.26 g/mol. Its IUPAC name is N-(6-ethoxy-2-pyridinyl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-ethoxy-2-pyridinyl)methanesulfonamide
PubChem CID86799055
Molecular FormulaC8H12N2O3S
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC NameN-(6-ethoxy-2-pyridinyl)methanesulfonamide
SMILESCCOc1cccc(NS(C)(=O)=O)n1
InChIInChI=1S/C8H12N2O3S/c1-3-13-8-6-4-5-7(9-8)10-14(2,11)12/h4-6H,3H2,1-2H3,(H,9,10)
InChIKeyYDWJPXYMDPYGSE-UHFFFAOYSA-N
XLogP0.85
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-ethoxy-2-pyridinyl)propane-1-sulfonamide
CID 84596816
4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide
CID 138021169
N-(2-chloroethyl)-6-ethoxypyridin-2-amine
CID 65029665
methyl 3-[(6-ethoxy-2-pyridinyl)amino]propanoate
CID 63591109
6-ethoxy-N-(2-methylcyclopropyl)pyridin-2-amine
CID 63591128
6-ethoxy-N-(2-methoxy-2-methylpropyl)pyridin-2-amine
CID 104762565
4-[(6-ethoxy-2-pyridinyl)amino]pyrrolidin-2-one
CID 106192160
6-ethoxy-N-(thietan-3-yl)pyridin-2-amine
CID 130659099
6-ethoxy-N-(3-methoxypropyl)pyridin-2-amine
CID 63590219
N-(azetidin-3-yl)-6-ethoxypyridin-2-amine
CID 66187269
N-(cyclobutylmethyl)-6-ethoxypyridin-2-amine
CID 63590749
tert-butyl N-[2-[(6-ethoxy-2-pyridinyl)amino]ethyl]carbamate
CID 115735888

Frequently Asked Questions

What is the IUPAC name of N-(6-ethoxy-2-pyridinyl)methanesulfonamide?
The IUPAC name of N-(6-ethoxy-2-pyridinyl)methanesulfonamide (CID 86799055) is N-(6-ethoxy-2-pyridinyl)methanesulfonamide.
What is the SMILES notation for N-(6-ethoxy-2-pyridinyl)methanesulfonamide?
The canonical SMILES for N-(6-ethoxy-2-pyridinyl)methanesulfonamide is CCOc1cccc(NS(C)(=O)=O)n1.
What is the InChIKey of N-(6-ethoxy-2-pyridinyl)methanesulfonamide?
The InChIKey is YDWJPXYMDPYGSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S/c1-3-13-8-6-4-5-7(9-8)10-14(2,11)12/h4-6H,3H2,1-2H3,(H,9,10).
What are the key properties of N-(6-ethoxy-2-pyridinyl)methanesulfonamide?
N-(6-ethoxy-2-pyridinyl)methanesulfonamide has a molecular weight of 216.26 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-ethoxy-2-pyridinyl)methanesulfonamide is sourced from PubChem (CID 86799055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).